AC1N40HE

4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-(3,6-dimethyl-1,3-benzothiazol-2-ylidene)benzamide

Also Known As: Oprea1_185394|SR-01000444346-1|F0473-0245|N-[(2E)-3,6-dimethyl-2,3-dihydro-1,3-benzothiazol-2-ylidene]-4-(1,2,3,4-tetrahydroisoquinoline-2-sulfonyl)benzamide|(E)-4-((3,4-dihydroisoquinolin-2(1H)-yl)sulfonyl)-N-(3,6-dimethylbenzo[d]thiazol-2(3H)-ylidene)benzamide|4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-(3,6-dimethyl-1,3-benzothiazol-2-ylidene)benzamide|4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-(3,6-dimethylbenzothiazol-2-ylidene)benzamide

Molecular Formula	C25H23N3O3S2
Molecular Weight	477.11807 g/mol
LogP	4.03632
Topological Polar Surface Area	71.74 Ų
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	4
Rotatable Bonds	3
Exact Mass	477.11807
Monoisotopic Mass	477.11807
Heavy Atoms	33
Complexity	1548.0676

Chemical Identifiers

CAS Number	391876-48-5
SMILES	CC1=CC2=C(C=C1)N(C(=NC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCC5=CC=CC=C5C4)S2)C