AC1MGQGX

3-methyl-8-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]-7-prop-2-enylpurine-2,6-dione

Also Known As: AB00531936-02|SR-01000304366-1|3-methyl-8-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]-7-(prop-2-en-1-yl)-2,3,6,7-tetrahydro-1H-purine-2,6-dione|3-methyl-8-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]-7-prop-2-enylpurine-2,6-dione|7-Allyl-3-methyl-8-(4-methyl-thiazol-2-ylsulfanyl)-3,7-dihydro-purine-2,6-dione|7-allyl-3-methyl-8-((4-methylthiazol-2-yl)thio)-1H-purine-2,6(3H,7H)-dione|3-methyl-8-(4-methyl(1,3-thiazol-2-ylthio))-7-prop-2-enyl-1,3,7-trihydropurine -2,6-dione|6-hydroxy-3-methyl-8-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]-7-(prop-2-en-1-yl)-3,7-dihydro-2H-purin-2-one

Molecular Formula	C13H13N5O2S2
Molecular Weight	335.05106 g/mol
LogP	1.52542
Topological Polar Surface Area	85.57 Ų
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	6
Rotatable Bonds	4
Exact Mass	335.05106
Monoisotopic Mass	335.05106
Heavy Atoms	22
Complexity	978.62573

Chemical Identifiers

CAS Number	838898-91-2
SMILES	CC1=CSC(=N1)SC2=NC3=C(N2CC=C)C(=O)NC(=O)N3C