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N-[4-[(E)-N-[(3,6-dichloro-1-benzothiophene-2-carbonyl)amino]-C-methylcarbonimidoyl]phenyl]-1,3-benzodioxole-5-carboxamide

Also Known As: AK-968/41025768|N-(4-{N-[(3,6-dichloro-1-benzothien-2-yl)carbonyl]ethanehydrazonoyl}phenyl)-1,3-benzodioxole-5-carboxamide|N-[4-[(E)-N-[(3,6-dichloro-1-benzothiophene-2-carbonyl)amino]-C-methylcarbonimidoyl]phenyl]-1,3-benzodioxole-5-carboxamide|N-{(1E)-2-[4-(2H-benzo[3,4-d]1,3-dioxolen-5-ylcarbonylamino)phenyl]-1-azaprop- 1-enyl}(3,6-dichlorobenzo[b]thiophen-2-yl)carboxamide|N-{4-[(1E)-1-{2-[(3,6-dichloro-1-benzothiophen-2-yl)carbonyl]hydrazinylidene}ethyl]phenyl}-1,3-benzodioxole-5-carboxamide

Molecular Formula	C25H17Cl2N3O4S
Molecular Weight	525.0317 g/mol
LogP	6.3431
Topological Polar Surface Area	89.02 Ų
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	6
Rotatable Bonds	5
Exact Mass	525.0317
Monoisotopic Mass	525.0317
Heavy Atoms	35
Complexity	1498.8768

Chemical Identifiers

CAS Number	445244-52-0
SMILES	C/C(=N\NC(=O)C1=C(C2=C(S1)C=C(C=C2)Cl)Cl)/C3=CC=C(C=C3)NC(=O)C4=CC5=C(C=C4)OCO5