AC1NRGJ0

7-[(E)-but-2-enyl]-3-methyl-8-(3-methylbutylsulfanyl)purine-2,6-dione

Also Known As: Oprea1_357312|BAS 00964793|A2183/0091761|7-[(E)-but-2-enyl]-3-methyl-8-(3-methylbutylsulfanyl)purine-2,6-dione|(E)-7-(but-2-en-1-yl)-8-(isopentylthio)-3-methyl-1H-purine-2,6(3H,7H)-dione|7-[(E)-2-butenyl]-8-(isopentylsulfanyl)-3-methyl-3,7-dihydro-1H-purine-2,6-dione|7-But-2-enyl-3-methyl-8-(3-methyl-butylsulfanyl)-3,7-dihydro-purine-2,6-dione|7-[(2E)-BUT-2-EN-1-YL]-3-METHYL-8-[(3-METHYLBUTYL)SULFANYL]-2,3,6,7-TETRAHYDRO-1H-PURINE-2,6-DIONE|7-[(2E)-but-2-en-1-yl]-3-methyl-8-[(3-methylbutyl)sulfanyl]-3,7-dihydro-1H-purine-2,6-dione

Molecular Formula	C15H22N4O2S
Molecular Weight	322.14636 g/mol
LogP	2.1376
Topological Polar Surface Area	72.68 Ų
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	4
Rotatable Bonds	6
Exact Mass	322.14636
Monoisotopic Mass	322.14636
Heavy Atoms	22
Complexity	798.2009

Chemical Identifiers

CAS Number	306733-06-2
SMILES	C/C=C/CN1C2=C(N=C1SCCC(C)C)N(C(=O)NC2=O)C