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199986-75-9

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199986-75-9 Structure

199986-75-9 Structure
IdentificationBack Directory
[Name]

2(BIS-(HYDROXYETHYL)AMINO)-6-(4-METHOXYBENZYLAMINO)-9-ISOPROPYL-PURINE
[CAS]

199986-75-9
[Synonyms]

BAT5
NG 26
D6S82E
CVT-313
CS-2441
CVT-313, >98%
CVT-313(NG-26)
CDK2 INHIBITOR III
CVT 313;NG 26;CVT313;NG26
CVT-313 (CDK2 INHIBITOR III)
CVT 313;NG 26;CVT313;NG26;NG-26
Anti-ABHD16A antibody produced in rabbit
Cdk2 Inhibitor III - CAS 199986-75-9 - Calbiochem
2(BIS-(HYDROXYETHYL)AMINO)-6-(4-METHOXYBENZYLAMINO)-9-ISOPROPYL-PURINE
2,2'-(9-isopropyl-6-(4-methoxybenzylamino)-9H-purin-2-ylazanediyl)diethanol
2,2'-[[6-[[(4-Methoxyphenyl)methyl]amino]-9-(1-methylethyl)-9H-purin-2-yl]imino]bisethanol
Ethanol,2,2'-[[6-[[(4-methoxyphenyl)methyl]amino]-9-(1-methylethyl)-9H-purin-2-yl]imino]bis-
[Molecular Formula]

C20H28N6O3
[MDL Number]

MFCD06411412
[MOL File]

199986-75-9.mol
[Molecular Weight]

400.47
Chemical PropertiesBack Directory
[Boiling point ]

652.3±65.0 °C(Predicted)
[density ]

1.30±0.1 g/cm3(Predicted)
[storage temp. ]

Sealed in dry,Store in freezer, under -20°C
[solubility ]

≥20 mg/mL in DMSO; insoluble in H2O; ≥51.1 mg/mL in EtOH with gentle warming
[form ]

White solid
[pka]

13.95±0.10(Predicted)
[color ]

White to off-white
[biological source]

rabbit
[InChI]

1S/C20H28N6O3/c1-14(2)26-13-22-17-18(21-12-15-4-6-16(29-3)7-5-15)23-20(24-19(17)26)25(8-10-27)9-11-28/h4-7,13-14,27-28H,8-12H2,1-3H3,(H,21,23,24)
[InChIKey]

NQVIIUBWMBHLOZ-UHFFFAOYSA-N
[SMILES]

[n]1(c2nc(nc(c2nc1)NCc3ccc(cc3)OC)N(CCO)CCO)C(C)C
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H302
[Precautionary statements ]

P280-P305+P351+P338
[WGK Germany ]

WGK 1
[Storage Class]

11 - Combustible Solids
Hazard InformationBack Directory
[Uses]

CVT 313 is a potent CDK2 inhibitor.
[Biological Activity]

Cell permeable: yes''Primary Target
Cdk2/ACdk2/E''Product competes with ATP.''Reversible: yes''Target IC50: 0.5 μM for Cdk2/A and Cdk2/E; 4.2 μM for Cdk1/B; 215 μM for Cdk4/D1
[IC 50]

cdk2/cyclin A: 0.5 μM (IC50); Cdk1/cyclin B: 4.2 μM (IC50); Cdk4/cyclin D1: 215 μM (IC50)
[storage]

Store at -20°C
Spectrum DetailBack Directory
[Spectrum Detail]

2(BIS-(HYDROXYETHYL)AMINO)-6-(4-METHOXYBENZYLAMINO)-9-ISOPROPYL-PURINE(199986-75-9)1HNMR
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