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TAE684

Molecular FormulaC₃₀H₄₀ClN₇O₃S
Average mass614.202 Da
Monoisotopic mass613.260193 Da
ChemSpider ID13166704

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Names and Synonyms

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

2,4-Pyrimidinediamine, 5-chloro-N²-[2-methoxy-4-[4-(4-methyl-1-piperazinyl)-1-piperidinyl]phenyl]-N⁴-[2-[(1-methylethyl)sulfonyl]phenyl]- [ACD/Index Name]

5-Chlor-N⁴-[2-(isopropylsulfonyl)phenyl]-N²-{2-methoxy-4-[4-(4-methyl-1-piperazinyl)-1-piperidinyl]phenyl}-2,4-pyrimidindiamin [German] [ACD/IUPAC Name]

5-Chloro-N⁴-[2-(isopropylsulfonyl)phenyl]-N²-{2-methoxy-4-[4-(4-methyl-1-piperazinyl)-1-piperidinyl]phenyl}-2,4-pyrimidinediamine [ACD/IUPAC Name]

5-Chloro-N⁴-[2-(isopropylsulfonyl)phényl]-N²-{2-méthoxy-4-[4-(4-méthyl-1-pipérazinyl)-1-pipéridinyl]phényl}-2,4-pyrimidinediamine [French] [ACD/IUPAC Name]

5-Chloro-N2-[2-methoxy-4-[4-(4-methyl-1-piperazinyl)-1-piperidinyl]phenyl]-N4-[2-[(1-methylethyl)sulfonyl]phenyl]-2,4-pyrimidinediamine

5-CHLORO-N2-{2-METHOXY-4-[4-(4-METHYLPIPERAZIN-1-YL)PIPERIDIN-1-YL]PHENYL}-N4-[2-(PROPANE-2-SULFONYL)PHENYL]PYRIMIDINE-2,4-DIAMINE

761439-42-3 [RN]

EH1713MN4K

NVP-TAE684 - TAE 684

TAE684

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TAE-684

[5-chloro-4-[(2-isopropylsulfonylphenyl)amino]pyrimidin-2-yl]-[2-methoxy-4-[4-(4-methylpiperazin-1-yl)-1-piperidyl]phenyl]amine

[761439-42-3] [RN]

2,4-Pyrimidinediamine, 5-chloro-N2-[2-methoxy-4-[4-(4-methyl-1-piperazinyl)-1-piperidinyl]phenyl]-N4-[2-[(1-methylethyl)sulfonyl]phenyl]-

2,4-Pyrimidinediamine,5-chloro-N2-[2-methoxy-4-[4-(4-methyl-1-piperazinyl)-1-piperidinyl]phenyl]-N4-[2-[(1-methylethyl)sulfonyl]phenyl]-

5-chloro-N2-[2-methoxy-4-[4-(4-methyl-1-piperazinyl)-1-piperidinyl]phenyl]-N4-[2-[(1-methylethyl)sulfonyl]phenyl]-2,4-pyrimidinediamine

5-?chloro-?N2-?[2-?methoxy-?4-?[4-?(4-?methyl-?1-?piperazinyl)?-?1-?piperidinyl]?phenyl]?-?N4-?[2-?[(1-?methylethyl)?sulfonyl]?phenyl]?-2,?4-pyrimidinediamine

5-chloro-2-N-[2-methoxy-4-[4-(4-methylpiperazin-1-yl)piperidin-1-yl]phenyl]-4-N-(2-propan-2-ylsulfonylphenyl)pyrimidine-2,4-diamine

5-chloro-2-N-{2-methoxy-4-[4-(4-methylpiperazin-1-yl)piperidin-1-yl]phenyl}-4-N-[2-(propane-2-sulfonyl)phenyl]pyrimidine-2,4-diamine

5-chloro-N'-(2-isopropylsulfonylphenyl)-N-[2-methoxy-4-[4-(4-methyl-1-piperazinyl)-1-piperidinyl]phenyl]pyrimidine-2,4-diamine

5-chloro-N'-(2-isopropylsulfonylphenyl)-N-[2-methoxy-4-[4-(4-methylpiperazin-1-yl)-1-piperidyl]phenyl]pyrimidine-2,4-diamine

5-chloro-N-[2-methoxy-4-[4-(4-methylpiperazin-1-yl)piperidin-1-yl]phenyl]-N'-(2-propan-2-ylsulfonylphenyl)pyrimidine-2,4-diamine

5-chloro-N²-{2-methoxy-4-[4-(4-methylpiperazin-1-yl)piperidin-1-yl]phenyl}-N⁴-[2-(propan-2-ylsulfonyl)phenyl]pyrimidine-2,4-diamine

5-chloro-N2-[2-methoxy-4-[4-(4-methyl-1-piperazinyl)-1-piperidinyl]phenyl]-N4-(2-propan-2-ylsulfonylphenyl)pyrimidine-2,4-diamine

5-chloro-N2-[2-methoxy-4-[4-(4-methyl-1-pyperidinyl]-N4-[2-[(1-methylethyl)sulfonyl]phenyl]-2,4-Pyrimidinediamine

5-chloro-N4-(2-(isopropylsulfonyl)phenyl)-N2-(2-methoxy-4-(4-(4-methylpiperazin-1-yl)piperidin-1-yl)phenyl)pyrimidine-2,4-diamine

CHEMBL509032

GUI

Kinome_1205

MFCD11977634 [MDL number]

NVP TAE 684

NVP TAE684

NVP-TAE 684

NVP-TAE 684|TAE-684|TAE684

NVP-TAE684

nv--tae684

pentanedioate

pentanedioate;Glutaric acid

TAE 684

TAE684 (NVP-TAE684)

TAE684; NVP TAE684

UNII:EH1713MN4K

UNII-EH1713MN4K

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Experimental data
Predicted - ACD/Labs
Predicted - ChemAxon
Predicted - Mcule

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

Density:	1.3±0.1 g/cm³
Boiling Point:	791.0±70.0 °C at 760 mmHg
Vapour Pressure:	0.0±2.8 mmHg at 25°C
Enthalpy of Vaporization:	115.1±3.0 kJ/mol
Flash Point:	432.2±35.7 °C
Index of Refraction:	1.622
Molar Refractivity:	166.8±0.4 cm³
#H bond acceptors:	10
#H bond donors:	2
#Freely Rotating Bonds:	9
#Rule of 5 Violations:	2

ACD/LogP:	2.71
ACD/LogD (pH 5.5):	1.06
ACD/BCF (pH 5.5):	1.00
ACD/KOC (pH 5.5):	4.89
ACD/LogD (pH 7.4):	2.72
ACD/BCF (pH 7.4):	36.98
ACD/KOC (pH 7.4):	222.31
Polar Surface Area:	111 Å²
Polarizability:	66.1±0.5 10^-24cm³
Surface Tension:	57.8±3.0 dyne/cm
Molar Volume:	473.6±3.0 cm³

Click to predict properties on the Chemicalize site

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TAE684

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