AC1MZG2G

ethyl 6-amino-4-(2-chloro-6-fluorophenyl)-5-cyano-2-[(3-cyano-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridin-2-yl)sulfanylmethyl]-4H-pyran-3-carboxylate

Also Known As: KS-00003RZ5|SS-0546|AM-807/14957154|ethyl 6-amino-4-(2-chloro-6-fluorophenyl)-5-cyano-2-[(3-cyano-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridin-2-yl)sulfanylmethyl]-4H-pyran-3-carboxylate|ethyl 6-amino-4-(2-chloro-6-fluorophenyl)-5-cyano-2-{[(3-cyano-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridin-2-yl)sulfanyl]methyl}-4H-pyran-3-carboxylate|Ethyl 6-amino-4-(2-chloro-6-fluorophenyl)-5-cyano-2-(((3-cyano-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridin-2-yl)thio)methyl)-4H-pyran-3-carboxylate|ethyl 6-amino-4-(2-chloro-6-fluorophenyl)-5-cyano-2-[({3-cyano-5H,6H,7H,8H,9H-cyclohepta[b]pyridin-2-yl}sulfanyl)methyl]-4H-pyran-3-carboxylate|ethyl 6-amino-4-(2-chloro-6-fluorophenyl)-5-cyano-2-{[(3-cyano-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridin-2-yl)sulfanyl]|ethyl6-amino-4-(2-chloro-6-fluorophenyl)-5-cyano-2-[({3-cyano-5H,6H,7H,8H,9H-cyclohepta[b]pyridin-2-yl}sulfanyl)methyl]-4H-pyran-3-carboxylate

Molecular Formula	C27H24ClFN4O3S
Molecular Weight	538.12415 g/mol
LogP	5.43186
Topological Polar Surface Area	122.02 Ų
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	8
Rotatable Bonds	6
Exact Mass	538.12415
Monoisotopic Mass	538.12415
Heavy Atoms	37
Complexity	1372.9908

Chemical Identifiers

CAS Number	445384-30-5
SMILES	CCOC(=O)C1=C(OC(=C(C1C2=C(C=CC=C2Cl)F)C#N)N)CSC3=C(C=C4CCCCCC4=N3)C#N