2-[(4-chlorobenzoyl)amino]-N-(3-pyridinylmethyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

Base Information

• Chemical Name: 2-[(4-chlorobenzoyl)amino]-N-(3-pyridinylmethyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
• CAS No.: 609796-21-6
• Molecular Formula: C22H20ClN3O2S
• Molecular Weight: 425.9
• European Community (EC) Number: 646-091-6
• Mol file: 609796-21-6.mol

Synonyms:609796-21-6;2-[(4-chlorobenzoyl)amino]-N-(3-pyridinylmethyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide;2-[(4-chlorobenzoyl)amino]-N-(pyridin-3-ylmethyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide;CBKinase1_002635;CBKinase1_015035;2-(4-chlorobenzamido)-N-(pyridin-3-ylmethyl)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxamide;Oprea1_586356;STK880488;AKOS000527081;AB00674335-01;AF-399/41899021;SR-01000908736;SR-01000908736-1;BRD-K32961781-001-01-3;F1423-0395;2-{[(4-chlorophenyl)carbonyl]amino}-N-(pyridin-3-ylmethyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

Chemical Property of 2-[(4-chlorobenzoyl)amino]-N-(3-pyridinylmethyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

Chemical Property:

• XLogP3: 4.9
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 5
• Exact Mass: 425.0964758
• Heavy Atom Count: 29
• Complexity: 584

Purity/Quality:

2-[(4-CHLOROBENZOYL)AMINO]-N-(3-PYRIDINYLMETHYL)-4,5,6,7-TETRAHYDRO-1-BENZOTHIOPHENE-3-CARBOXAMIDE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

Useful:

• Canonical SMILES: C1CCC2=C(C1)C(=C(S2)NC(=O)C3=CC=C(C=C3)Cl)C(=O)NCC4=CN=CC=C4