N-cyclopentyl-1-{4-[(4-methylbenzene-1-sulfonyl)amino]benzoyl}piperidine-4-carboxamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
N-cyclopentyl-1-{4-[(4-methylbenzene-1-sulfonyl)amino]benzoyl}piperidine-4-carboxamide--trifluoroacetic acid (1/1)
N-cyclopentyl-1-{4-[(4-methylbenzene-1-sulfonyl)amino]benzoyl}piperidine-4-carboxamide--trifluoroacetic acid (1/1)
Compound characteristics
Compound ID: | L445-0089 |
Compound Name: | N-cyclopentyl-1-{4-[(4-methylbenzene-1-sulfonyl)amino]benzoyl}piperidine-4-carboxamide--trifluoroacetic acid (1/1) |
Molecular Weight: | 583.63 |
Molecular Formula: | C25 H31 N3 O4 S |
Salt: | CF3COOH |
Smiles: | Cc1ccc(cc1)S(Nc1ccc(cc1)C(N1CCC(CC1)C(NC1CCCC1)=O)=O)(=O)=O |
Stereo: | ACHIRAL |
logP: | 3.3013 |
logD: | 2.4512 |
logSw: | -3.5941 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 82.041 |
InChI Key: | ZDGOJCHRMVADGS-UHFFFAOYSA-N |