78721-04-7
1H-PURINE-2,6-DIONE, 3,7-DIHYDRO-1,3-DIMETHYL-7-(3-(DIMETHYLAMINO)-2-H YDROXYPROPYL)-8-((PHENYLMETHYL)AMINO)-, MONOHYDROCHLORIDE
Name
1H-PURINE-2,6-DIONE, 3,7-DIHYDRO-1,3-DIMETHYL-7-(3-(DIMETHYLAMINO)-2-H YDROXYPROPYL)-8-((PHENYLMETHYL)AMINO)-, MONOHYDROCHLORIDE
Formula
C19 H26 N6 O3 . Cl H
MolWeight
422.914
1Identification
【Name】
1H-PURINE-2,6-DIONE, 3,7-DIHYDRO-1,3-DIMETHYL-7-(3-(DIMETHYLAMINO)-2-H YDROXYPROPYL)-8-((PHENYLMETHYL)AMINO)-, MONOHYDROCHLORIDE
【CAS】
【MDL】
MFCD01694371
【English Synonyms】
【Formula】
C19 H26 N6 O3 . Cl H
【MolWeight】
422.914
【Inchi】
InChI=1S/C19H26N6O3.ClH/c1-22(2)11-14(26)12-25-15-16(23(3)19(28)24(4)17(15)27)21-18(25)20-10-13-8-6-5-7-9-13;/h5-9,14,26H,10-12H2,1-4H3,(H,20,21);1H
【InChIKey】
InChIKey=UEOXELDRXQEZCT-UHFFFAOYSA-N
【SMILES】
Cn1c2c(c(=O)n(c1=O)C)n(c(n2)NCc3ccccc3)CC(CN(C)C)O.Cl
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:9
XLogP3:0.0
Bulk/Fine:F