AC1LTJ02

ethyl 2-[[(E)-3-[5-(3-chlorophenyl)furan-2-yl]-2-cyanoprop-2-enoyl]amino]-4-(4-methoxyphenyl)thiophene-3-carboxylate

Also Known As: ethyl 2-({(2E)-3-[5-(3-chlorophenyl)furan-2-yl]-2-cyanoprop-2-enoyl}amino)-4-(4-methoxyphenyl)thiophene-3-carboxylate|ethyl 2-[[(E)-3-[5-(3-chlorophenyl)furan-2-yl]-2-cyanoprop-2-enoyl]amino]-4-(4-methoxyphenyl)thiophene-3-carboxylate|(E)-ethyl 2-(3-(5-(3-chlorophenyl)furan-2-yl)-2-cyanoacrylamido)-4-(4-methoxyphenyl)thiophene-3-carboxylate|ethyl 2-{(2E)-3-[5-(3-chlorophenyl)(2-furyl)]-2-cyanoprop-2-enoylamino}-4-(4-m ethoxyphenyl)thiophene-3-carboxylate

Molecular Formula	C28H21ClN2O5S
Molecular Weight	532.086 g/mol
LogP	7.05948
Topological Polar Surface Area	101.56 Ų
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	7
Rotatable Bonds	8
Exact Mass	532.086
Monoisotopic Mass	532.086
Heavy Atoms	37
Complexity	1512.0626

Chemical Identifiers

CAS Number	373375-10-1
SMILES	CCOC(=O)C1=C(SC=C1C2=CC=C(C=C2)OC)NC(=O)/C(=C/C3=CC=C(O3)C4=CC(=CC=C4)Cl)/C#N