AC1LZGBL

ethyl 4-[[(2Z)-2-cyano-2-(3,3-dimethyl-2,4-dihydroisoquinolin-1-ylidene)acetyl]amino]benzoate

Also Known As: Oprea1_344684|BAS 00329300|BIM-0028123.P001|(Z)-ethyl 4-(2-cyano-2-(3,3-dimethyl-3,4-dihydroisoquinolin-1(2H)-ylidene)acetamido)benzoate|ethyl 4-[2-(3,3-dimethyl(2,3,4-trihydroisoquinolylidene))-2-cyanoacetylamino]b enzoate|ethyl 4-[[(2Z)-2-cyano-2-(3,3-dimethyl-2,4-dihydroisoquinolin-1-ylidene)acetyl]amino]benzoate|ethyl 4-{[(2Z)-2-cyano-2-(3,3-dimethyl-3,4-dihydroisoquinolin-1(2H)-ylidene)acetyl]amino}benzoate

Molecular Formula	C23H23N3O3
Molecular Weight	389.17395 g/mol
LogP	3.66098
Topological Polar Surface Area	91.22 Ų
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	5
Rotatable Bonds	4
Exact Mass	389.17395
Monoisotopic Mass	389.17395
Heavy Atoms	29
Complexity	1014.40875

Chemical Identifiers

CAS Number	149652-16-4
SMILES	CCOC(=O)C1=CC=C(C=C1)NC(=O)/C(=C\2/C3=CC=CC=C3CC(N2)(C)C)/C#N