AC1MWCFA

2-[(2,5-dimethylphenyl)methylsulfanyl]-3-(4-ethoxyphenyl)-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one

Also Known As: 2-[(2,5-dimethylbenzyl)sulfanyl]-3-(4-ethoxyphenyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one|2-((2,5-dimethylbenzyl)thio)-3-(4-ethoxyphenyl)-5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidin-4(3H)-one|2-[(2,5-dimethylphenyl)methylsulfanyl]-3-(4-ethoxyphenyl)-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one|2-[(2,5-dimethylphenyl)methylthio]-3-(4-ethoxyphenyl)-3,5,6,7,8-pentahydrobenz o[b]thiopheno[2,3-d]pyrimidin-4-one

Molecular Formula	C27H28N2O2S2
Molecular Weight	476.1592 g/mol
LogP	6.63384
Topological Polar Surface Area	44.12 Ų
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	5
Rotatable Bonds	6
Exact Mass	476.1592
Monoisotopic Mass	476.1592
Heavy Atoms	33
Complexity	1369.8882

Chemical Identifiers

CAS Number	613226-82-7
SMILES	CCOC1=CC=C(C=C1)N2C(=O)C3=C(N=C2SCC4=C(C=CC(=C4)C)C)SC5=C3CCCC5