AC1M1X0A

2-[2-[1-(2-methoxyethyl)-2,5-dimethylpyrrol-3-yl]-2-oxoethyl]sulfanyl-5,6-dimethyl-3-prop-2-enylthieno[2,3-d]pyrimidin-4-one

Also Known As: Oprea1_271879|AB00522951-03|AF-399/40806242|F1174-3082|2-({2-[1-(2-methoxyethyl)-2,5-dimethyl-1H-pyrrol-3-yl]-2-oxoethyl}sulfanyl)-5,6-dimethyl-3-(prop-2-en-1-yl)-3H,4H-thieno[2,3-d]pyrimidin-4-one|3-allyl-2-((2-(1-(2-methoxyethyl)-2,5-dimethyl-1H-pyrrol-3-yl)-2-oxoethyl)thio)-5,6-dimethylthieno[2,3-d]pyrimidin-4(3H)-one|2-[2-[1-(2-methoxyethyl)-2,5-dimethylpyrrol-3-yl]-2-oxoethyl]sulfanyl-5,6-dimethyl-3-prop-2-enylthieno[2,3-d]pyrimidin-4-one|2-{2-[1-(2-methoxyethyl)-2,5-dimethylpyrrol-3-yl]-2-oxoethylthio}-5,6-dimethyl -3-prop-2-enyl-3-hydrothiopheno[2,3-d]pyrimidin-4-one|3-allyl-2-({2-[1-(2-methoxyethyl)-2,5-dimethyl-1H-pyrrol-3-yl]-2-oxoethyl}sulfanyl)-5,6-dimethylthieno[2,3-d]pyrimidin-4(3H)-one

Molecular Formula	C22H27N3O3S2
Molecular Weight	445.14938 g/mol
LogP	4.30058
Topological Polar Surface Area	66.12 Ų
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	6
Rotatable Bonds	9
Exact Mass	445.14938
Monoisotopic Mass	445.14938
Heavy Atoms	30
Complexity	1170.9454

Chemical Identifiers

CAS Number	379239-29-9
SMILES	CC1=CC(=C(N1CCOC)C)C(=O)CSC2=NC3=C(C(=C(S3)C)C)C(=O)N2CC=C