7,8-Dihydro-2-methyl-1H-thiopyrano[4,3-d]pyrimidin-4(5H)-one

Catalog Number	ACM284028906-1
CAS	284028-90-6
Structure
IUPAC Name	2-methyl-3,5,7,8-tetrahydrothiopyrano[4,3-d]pyrimidin-4-one
Synonyms	284028-90-6;7,8-Dihydro-2-methyl-1H-thiopyrano[4,3-d]pyrimidin-4(5H)-one;DR 2313;DR2313;2-Methyl-3,5,7,8-Tetrahydro-4h-Thiopyrano[4,3-D]pyrimidin-4-One;PARP Inhibitor XI, DR2313;CHEMBL483348;1,5,7,8-Tetrahydro-2-methyl-4H-thiopyrano[4,3-d]pyrimidin-4-one;IR 2313;2-methyl-7,8-dihydro-1H-thiopyrano[4,3-d]pyrimidin-4(5H)-one;2-methyl-1,5,7,8-tetrahydrothiopyrano[4,3-d]pyrimidin-4-one;4pnl;DRL;3c4h;SCHEMBL421328;SCHEMBL15105584;DTXSID10436871;HMS3269K13;HMS3413D09;HMS3677D09;2-Methyl-3,5,7,8-tetrahydrothiopyrano[4,3-d]pyrimidine-4-one;ACT08709;AMY10965;ANW-61702;BDBM50277614;MFCD08703132;ZINC13831221;AKOS006291031;AKOS025401612;DB07677;DR-2313;VZ25633;NCGC00167745-01;AC-22822;AS-35194;DB-024851;DR2313, >=98% (HPLC);A5393;FT-0657586;EC-000.2397;J-017060;J-519059;BRD-K94920105-001-01-3;Q27096894;2-methyl-3H,4H,5H,7H,8H-thiopyrano[4,3-d]pyrimidin-4-one;2-methyl-7,8-dihydro-3H-thiopyrano[4,3-d]pyrimidin-4(5H)-one;2-Methyl-7,8-dihydro-5H-thiopyrano[4,3-d]pyrimidine-4(3H)-one;4H-Thiopyrano[4,3-d]pyrimidin-4-one,3,5,7,8-tetrahydro-2-methyl-
Molecular Weight	182.25g/mol
Molecular Formula	C8H10N2OS
Canonical SMILES	CC1=NC2=C(CSCC2)C(=O)N1
InChI	InChI=1S/C8H10N2OS/c1-5-9-7-2-3-12-4-6(7)8(11)10-5/h2-4H2,1H3,(H,9,10,11)
InChI Key	HRYKZAKEAVZGJD-UHFFFAOYSA-N
Complexity	293
Covalently-Bonded Unit Count	1
Exact Mass	182.05138412g/mol
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	3
Monoisotopic Mass	182.05138412g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	66.8Å²
X Log P3	-0.2

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