AC1MNH2L

ethyl 4-(4-fluorophenyl)-2-[[2-[(12-oxo-11-phenyl-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9-trien-10-yl)sulfanyl]acetyl]amino]thiophene-3-carboxylate

Also Known As: ethyl 4-(4-fluorophenyl)-2-(2-((4-oxo-3-phenyl-4,5,6,7-tetrahydro-3H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-2-yl)thio)acetamido)thiophene-3-carboxylate|F1142-3979|ethyl 4-(4-fluorophenyl)-2-[2-({12-oxo-11-phenyl-7-thia-9,11-diazatricyclo[6.4.0.0^{2,6}]dodeca-1(8),2(6),9-trien-10-yl}sulfanyl)acetamido]thiophene-3-carboxylate|ethyl 4-(4-fluorophenyl)-2-[[2-[(12-oxo-11-phenyl-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9-trien-10-yl)sulfanyl]acetyl]amino]thiophene-3-carboxylate

Molecular Formula	C30H24FN3O4S3
Molecular Weight	605.0913 g/mol
LogP	6.711
Topological Polar Surface Area	90.29 Ų
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	8
Rotatable Bonds	8
Exact Mass	605.0913
Monoisotopic Mass	605.0913
Heavy Atoms	41
Complexity	1828.0939

Chemical Identifiers

CAS Number	690644-53-2
SMILES	CCOC(=O)C1=C(SC=C1C2=CC=C(C=C2)F)NC(=O)CSC3=NC4=C(C5=C(S4)CCC5)C(=O)N3C6=CC=CC=C6