AC1M2SH2

10-[2-(4-fluorophenyl)-2-oxoethyl]sulfanyl-11-prop-2-enyl-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9-trien-12-one

Also Known As: Oprea1_515380|BAS 04913256|AF-399/15031089|10-{[2-(4-fluorophenyl)-2-oxoethyl]sulfanyl}-11-(prop-2-en-1-yl)-7-thia-9,11-diazatricyclo[6.4.0.0^{2,6}]dodeca-1(8),2(6),9-trien-12-one|SR-01000477063-1|3-allyl-2-((2-(4-fluorophenyl)-2-oxoethyl)thio)-6,7-dihydro-3H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-4(5H)-one|F0863-0335|10-[2-(4-Fluorophenyl)-2-oxoethyl]sulfanyl-11-prop-2-enyl-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9-trien-12-one|3-allyl-2-{[2-(4-fluorophenyl)-2-oxoethyl]sulfanyl}-3,5,6,7-tetrahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-4-one|2-[2-(4-fluorophenyl)-2-oxoethylthio]-3-prop-2-enyl-3,5,6,7-tetrahydrocyclopen ta[2,1-d]pyrimidino[4,5-b]thiophen-4-one|2-{[2-(4-fluorophenyl)-2-oxoethyl]sulfanyl}-3-(prop-2-en-1-yl)-3,5,6,7-tetrahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-4-one

Molecular Formula	C20H17FN2O2S2
Molecular Weight	400.07153 g/mol
LogP	4.2468
Topological Polar Surface Area	51.96 Ų
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	5
Rotatable Bonds	6
Exact Mass	400.07153
Monoisotopic Mass	400.07153
Heavy Atoms	27
Complexity	1099.8525

Chemical Identifiers

CAS Number	314261-60-4
SMILES	C=CCN1C(=O)C2=C(N=C1SCC(=O)C3=CC=C(C=C3)F)SC4=C2CCC4