Found 1 result

Search term: DLHGOXCFHAOGFW-MXAYSNPKSA-N (Found by InChIKey (full match))
ChemSpider 2D Image | 7-[[(2Z)-2-(2-aminothiazol-4-yl)-2-ethoxyimino-acetyl]amino]-3-[[(3,4-dimethylthiazol-3-ium-2-yl)-methyl-amino]methyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate | C21H25N7O5S3

7-[[(2Z)-2-(2-aminothiazol-4-yl)-2-ethoxyimino-acetyl]amino]-3-[[(3,4-dimethylthiazol-3-ium-2-yl)-methyl-amino]methyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate

  • Molecular FormulaC21H25N7O5S3
  • Average mass551.662 Da
  • Monoisotopic mass551.107910 Da
  • ChemSpider ID23114134

  • Double-bond stereo - Double-bond stereo

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

7-{[(2Z)-2-(2-Amino-1,3-thiazol-4-yl)-2-(ethoxyimino)acetyl]amino}-3-{[(3,4-dimethyl-1,3-thiazol-3-ium-2-yl)(methyl)amino]methyl}-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-en-2-carboxylat [German] [ACD/IUPAC Name]
7-{[(2Z)-2-(2-Amino-1,3-thiazol-4-yl)-2-(éthoxyimino)acétyl]amino}-3-{[(3,4-diméthyl-1,3-thiazol-3-ium-2-yl)(méthyl)amino]méthyl}-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ène-2-carboxylate [French] [ACD/IUPAC Name]
2-[(7-{2-(2-Amino-thiazol-4-yl)-2-[(Z)-ethoxyimino]-acetylamino}-2-carboxy-8-oxo-5-thia-1-aza-bicyclo[4.2.0]oct-2-en-3-ylmethyl)-methyl-amino]-3,4-dimethyl-thiazol-3-ium
7-{[(2Z)-2-(2-amino-1,3-thiazol-4-yl)-2-(ethoxyimino)acetyl]amino}-3-{[(3,4-dimethyl-1,3-thiazol-3-ium-2-yl)(methyl)amino]methyl}-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate [ACD/IUPAC Name]
thiazolium, 2-[[[7-[[(2Z)-2-(2-amino-4-thiazolyl)-2-(ethoxyimino)-1-oxoethyl]amino]-2-carboxy-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-en-3-yl]methyl]methylamino]-3,4-dimethyl-, inner salt [ACD/Index Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density:
Boiling Point:
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Index of Refraction:
Molar Refractivity:
#H bond acceptors: 12
#H bond donors: 4
#Freely Rotating Bonds: 9
#Rule of 5 Violations:
ACD/LogP:
ACD/LogD (pH 5.5):
ACD/BCF (pH 5.5):
ACD/KOC (pH 5.5):
ACD/LogD (pH 7.4):
ACD/BCF (pH 7.4):
ACD/KOC (pH 7.4):
Polar Surface Area: 239 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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