AG002CHT

199986-75-9 | Ethanol, 2,2'-[[6-[[(4-methoxyphenyl)methyl]amino]-9-(1-methylethyl)-9H-purin-2-yl]imino]bis-

AG002CHT

SDS

COA

Price

$0.00

Add to Cart

Buy Now

WARNING This product is not for human or veterinary use.

CAS Number	199986-75-9
Catalog Number	AG002CHT(AGN-PC-0LVEWL)
Chemical Name	Ethanol, 2,2'-[[6-[[(4-methoxyphenyl)methyl]amino]-9-(1-methylethyl)-9H-purin-2-yl]imino]bis-
IUPAC Name	2-[2-hydroxyethyl-[6-[(4-methoxyphenyl)methylamino]-9-propan-2-ylpurin-2-yl]amino]ethanol
InChI	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)
InChI Key	NQVIIUBWMBHLOZ-UHFFFAOYSA-N
MDL Number	MFCD06411412
Molecular Formula	C20H28N6O3
Molecular Weight	400.4747
SMILES	C(C)(C)N1C2=NC(=NC(=C2N=C1)NCC1=CC=C(C=C1)OC)N(CCO)CCO
UNII	T5490K8I7S
Synonyms	2-(bis-(hydroxyethyl)amino)-6-(4-methoxybenzylamino)-9-isopropyl-purine, CVT 313, CVT-313, CVT-313, 199986-75-9, Cdk2 Inhibitor III, AC1OCFD4, UNII-T5490K8I7S, CVT 313, CHEMBL80713, T5490K8I7S, 2(bis-(Hydroxyethyl)amino)-6-(4-methoxybenzylamino)-9-isopropyl-purine, 2-[2-hydroxyethyl-[6-[(4-methoxyphenyl)methylamino]-9-propan-2-ylpurin-2-yl]amino]ethanol, 2-[(2-hydroxyethyl)(6-{[(4-methoxyphenyl)methyl]amino}-9-(propan-2-yl)-9H-purin-2-yl)amino]ethan-1-ol, Ethanol, 2,2'-((6-(((4-methoxyphenyl)methyl)amino)-9-(1-methylethyl)-9H-purin-2-yl)imino)bis-, NG 26, NG-36, Ethanol, 2,2'-[[6-[[(4-methoxyphenyl)methyl]amino]-9-(1-methylethyl)-9H-purin-2-yl]imino]bis-, GTPL5948, NG26, SCHEMBL1394958, CTK8F1270, DTXSID30173812, HMS3229E16, BCP17295, EX-A1225, ZINC1487345, CVT-313(NG-26), 3564AH, BDBM50113739, HSCI1_000262, IN1370, MFCD06411412, AKOS027257517, CCG-206835, CS-0881, NCGC00379012-01, AK213292, HY-15339, RT-012111, W-5332, J-012931, 2-(bis-(hydroxylethyl)amino)-6-(4-methoxybenzylamino)-9-isopropylpurine, 2,2'-((9-Isopropyl-6-((4-methoxybenzyl)amino)-9H-purin-2-yl)azanediyl)diethanol, 2,2'-(9-Isopropyl-6-(4-methoxybenzylamino)-9H-purin-2-ylazanediyl)diethanol, 2-{(2-Hydroxy-ethyl)-[9-isopropyl-6-(4-methoxy-benzylamino)-9H-purin-2-yl]-amino}-ethanol, 2,2'-[[6-[[(4-Methoxyphenyl)methyl]amino]-9-(1-methylethyl)-9H-purin-2-yl]imino]bis[ethanol], D0P2WA, C20H28N6O3, CID6918386, A3336, A15054, C109140, 2-(bis-(hydroxyethyl)amino)-6-(4-methoxybenzylamino)-9-isopropyl-purine,

Complexity	471
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	400.222g/mol
Formal Charge	0
Heavy Atom Count	29
Hydrogen Bond Acceptor Count	8
Hydrogen Bond Donor Count	3
Isotope Atom Count	0
Molecular Weight	400.483g/mol
Monoisotopic Mass	400.222g/mol
Rotatable Bond Count	10
Topological Polar Surface Area	109A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.6

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302
Packing Group
Precautionary statements	P280-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number