N-(cyclohexylmethyl)-1-{4-[(4-methylbenzene-1-sulfonyl)amino]benzoyl}piperidine-3-carboxamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
N-(cyclohexylmethyl)-1-{4-[(4-methylbenzene-1-sulfonyl)amino]benzoyl}piperidine-3-carboxamide--trifluoroacetic acid (1/1)
N-(cyclohexylmethyl)-1-{4-[(4-methylbenzene-1-sulfonyl)amino]benzoyl}piperidine-3-carboxamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | L444-0239 |
| Compound Name: | N-(cyclohexylmethyl)-1-{4-[(4-methylbenzene-1-sulfonyl)amino]benzoyl}piperidine-3-carboxamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 611.68 |
| Molecular Formula: | C27 H35 N3 O4 S |
| Salt: | CF3COOH |
| Smiles: | Cc1ccc(cc1)S(Nc1ccc(cc1)C(N1CCCC(C1)C(NCC1CCCCC1)=O)=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.4062 |
| logD: | 3.5561 |
| logSw: | -4.1546 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 82.075 |
| InChI Key: | YKILBKJRQWKTNA-QHCPKHFHSA-N |