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156 hits found in 0.12 seconds.
Search terms: C22H23NO7S

Found by empirical formula

GridTileTableRecordChemReferEntrezPubChem

1

ID

Structure

Empirical Formula

Molecular Weight

Monoisotopic Mass, Da

LogP

ACD/LogD (pH 5.5)

ACD/LogD (pH 7.4)

InChI=1/C22H23NO7S/c1-16-6-12-21(13-7-16)31(27,28)30-15-19-5-3-2-4-18(19)14-29-22(24)17-8-10-20(11-9-17)23(25)26/h2-3,6-13,18-19H,4-5,14-15H2,1H3

C₂₂H₂₃NO₇S

445.4855

445.119522

ACD/LogP:	4.78
XLogP:	4.70

InChI=1/C20H19NO2.C2H4O5S/c1-13-17-12-20(23-3)19(22-2)11-15(17)10-18-16-7-5-4-6-14(16)8-9-21(13)18;3-2(4)1-8(5,6)7/h4-13H,1-3H3;1H2,(H,3,4)(H,5,6,7)

C₂₂H₂₃NO₇S

445.4855

445.119522

ACD/LogP:

4.65

InChI=1/C22H23NO7S/c1-5-28-17-8-10-18(11-9-17)31(26,27)23(15(4)24)16-7-12-20-19(13-16)21(14(3)30-20)22(25)29-6-2/h7-13H,5-6H2,1-4H3

C₂₂H₂₃NO₇S

445.4855

445.119522

ACD/LogP:	4.60
XLogP:	3.40

InChI=1/C22H23NO7S/c1-27-14-8-5-12(11-15(14)28-2)6-10-17(24)23-20-19(22(26)30-4)18-13(21(25)29-3)7-9-16(18)31-20/h5-6,8,10-11,13H,7,9H2,1-4H3,(H,23,24)/b10-6+/t13-/m1/s1

C₂₂H₂₃NO₇S

445.4855

445.119522

ACD/LogP:	4.36
XLogP:	1.80

4.36

4.36

InChI=1/C22H23NO7S/c1-27-14-8-5-12(11-15(14)28-2)6-10-17(24)23-20-19(22(26)30-4)18-13(21(25)29-3)7-9-16(18)31-20/h5-6,8,10-11,13H,7,9H2,1-4H3,(H,23,24)/b10-6+/t13-/m0/s1

C₂₂H₂₃NO₇S

445.4855

445.119522

ACD/LogP:	4.36
XLogP:	1.80

4.36

4.36

InChI=1/C22H23NO7S/c1-5-6-20(24)23(31(26,27)17-10-8-16(28-3)9-11-17)15-7-12-19-18(13-15)21(14(2)30-19)22(25)29-4/h7-13H,5-6H2,1-4H3

C₂₂H₂₃NO₇S

445.4855

445.119522

ACD/LogP:	4.60
XLogP:	3.30

4.6

4.6

InChI=1/C22H23NO7S/c1-4-23(5-2)31(26,27)18-9-6-15(7-10-18)22(25)29-14-16-12-21(24)30-20-13-17(28-3)8-11-19(16)20/h6-13H,4-5,14H2,1-3H3

C₂₂H₂₃NO₇S

445.4855

445.119522

ACD/LogP:	4.65
XLogP:	3.20

4.65

4.65

InChI=1/C22H23NO7S/c1-28-19-7-5-18(6-8-19)21(24)16-30-22(25)11-4-17-2-9-20(10-3-17)31(26,27)23-12-14-29-15-13-23/h2-11H,12-16H2,1H3/b11-4+

C₂₂H₂₃NO₇S

445.4855

445.119522

ACD/LogP:	2.58
XLogP:	2.20

InChI=1/C22H23NO7S/c1-3-27-22(26)19-15(8-13-4-7-16-17(9-13)30-11-29-16)12(2)31-20(19)23-18(24)10-28-21(25)14-5-6-14/h4,7,9,14H,3,5-6,8,10-11H2,1-2H3,(H,23,24)

C₂₂H₂₃NO₇S

445.4855

445.119522

ACD/LogP:	4.94
XLogP:	2.60

4.94

4.94

InChI=1/C22H23NO7S/c1-27-15-8-4-6-13(20(15)28-2)10-11-18(25)30-12-17(24)23-21-19(22(26)29-3)14-7-5-9-16(14)31-21/h4,6,8,10-11H,5,7,9,12H2,1-3H3,(H,23,24)/b11-10+

C₂₂H₂₃NO₇S

445.4855

445.119522

ACD/LogP:	4.74
XLogP:	2.00

4.74

4.74

InChI=1/C22H23NO7S/c1-28-20(25)14-8-9-15(21(26)29-2)16(10-14)23-19(24)12-30-22(27)18-11-13-6-4-3-5-7-17(13)31-18/h8-11H,3-7,12H2,1-2H3,(H,23,24)

C₂₂H₂₃NO₇S

445.4855

445.119522

ACD/LogP:	6.30
XLogP:	3.00

6.3

6.3

InChI=1/C22H23NO7S/c1-27-19-8-5-16(13-21(19)31(25,26)23-11-3-2-4-12-23)6-10-22(24)30-17-7-9-18-20(14-17)29-15-28-18/h5-10,13-14H,2-4,11-12,15H2,1H3/b10-6+

C₂₂H₂₃NO₇S

445.4855

445.119522

ACD/LogP:	4.01
XLogP:	3.40

4.01

4.01

InChI=1/C22H23NO7S/c24-19(17-6-9-20-21(14-17)29-13-12-28-20)15-30-22(25)16-4-7-18(8-5-16)31(26,27)23-10-2-1-3-11-23/h4-9,14H,1-3,10-13,15H2

C₂₂H₂₃NO₇S

445.4855

445.119522

ACD/LogP:	4.35
XLogP:	2.90

4.35

4.35

InChI=1/C22H23NO7S/c1-4-17-13(3)20(22(26)27-5-2)21(31-17)23-18(24)11-28-19(25)9-7-14-6-8-15-16(10-14)30-12-29-15/h6-10H,4-5,11-12H2,1-3H3,(H,23,24)/b9-7+

C₂₂H₂₃NO₇S

445.4855

445.119522

ACD/LogP:	5.84
XLogP:	3.10

5.84

5.84

InChI=1/C22H23NO7S/c1-31(28,29)21-12-11-18(13-19(21)23(26)27)22(25)30-14-20(24)17-9-7-16(8-10-17)15-5-3-2-4-6-15/h7-13,15H,2-6,14H2,1H3

C₂₂H₂₃NO₇S

445.4855

445.119522

ACD/LogP:	4.73
XLogP:	5.50

4.73

4.73

InChI=1/C22H23NO7S/c24-19(15-30-22(25)17-6-9-20-21(14-17)29-13-12-28-20)16-4-7-18(8-5-16)31(26,27)23-10-2-1-3-11-23/h4-9,14H,1-3,10-13,15H2

C₂₂H₂₃NO₇S

445.4855

445.119522

ACD/LogP:	4.06
XLogP:	2.90

4.06

4.06

InChI=1/C22H23NO7S/c1-27-14-8-5-12(11-15(14)28-2)6-10-17(24)23-20-19(22(26)30-4)18-13(21(25)29-3)7-9-16(18)31-20/h5-6,8,10-11,13H,7,9H2,1-4H3,(H,23,24)

C₂₂H₂₃NO₇S

445.4855

445.119522

ACD/LogP:	4.36
XLogP:	1.80

4.36

4.36

InChI=1/C22H23NO7S/c1-27-22(26)19-14-5-3-2-4-6-17(14)31-20(19)23-18(24)12-30-21(25)13-7-8-15-16(11-13)29-10-9-28-15/h7-8,11H,2-6,9-10,12H2,1H3,(H,23,24)

C₂₂H₂₃NO₇S

445.4855

445.119522

ACD/LogP:	5.80
XLogP:	3.00

5.8

5.8

InChI=1/C22H23NO7S/c24-18(14-29-22(25)21-15-28-19-6-2-3-7-20(19)30-21)16-8-10-17(11-9-16)31(26,27)23-12-4-1-5-13-23/h2-3,6-11,21H,1,4-5,12-15H2

C₂₂H₂₃NO₇S

445.4855

445.119522

ACD/LogP:	3.63
XLogP:	2.70

3.63

3.63

InChI=1/C22H23NO7S/c1-15(24)30-20-9-7-17(8-10-20)16-3-5-18(6-4-16)22(26)29-13-21(25)23(2)19-11-12-31(27,28)14-19/h3-10,19H,11-14H2,1-2H3

C₂₂H₂₃NO₇S

445.4855

445.119522

ACD/LogP:	1.34
XLogP:	2.90

1

Royal Society of Chemistry