AC1LYP4C

ethyl 2-[[(E)-2-cyano-3-(5-phenylfuran-2-yl)prop-2-enoyl]amino]-4-phenylthiophene-3-carboxylate

Also Known As: (E)-ethyl 2-(2-cyano-3-(5-phenylfuran-2-yl)acrylamido)-4-phenylthiophene-3-carboxylate|ethyl 2-[(2E)-2-cyano-3-(5-phenyl(2-furyl))prop-2-enoylamino]-4-phenylthiophen e-3-carboxylate|ethyl 2-[[(E)-2-cyano-3-(5-phenylfuran-2-yl)prop-2-enoyl]amino]-4-phenylthiophene-3-carboxylate|Ethyl 2-[[2-cyano-3-(5-phenyl-2-furyl)prop-2-enoyl]amino]-4-phenyl-thiophene-3-carboxylate|ethyl 2-{[(2E)-2-cyano-3-(5-phenylfuran-2-yl)prop-2-enoyl]amino}-4-phenylthiophene-3-carboxylate

Molecular Formula	C27H20N2O4S
Molecular Weight	468.11438 g/mol
LogP	6.39748
Topological Polar Surface Area	92.33 Ų
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	6
Rotatable Bonds	7
Exact Mass	468.11438
Monoisotopic Mass	468.11438
Heavy Atoms	34
Complexity	1379.0183

Chemical Identifiers

CAS Number	373375-45-2
SMILES	CCOC(=O)C1=C(SC=C1C2=CC=CC=C2)NC(=O)/C(=C/C3=CC=C(O3)C4=CC=CC=C4)/C#N