1-{4-[(4-methylbenzene-1-sulfonyl)amino]benzoyl}-N-(3-methylbutyl)piperidine-3-carboxamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
1-{4-[(4-methylbenzene-1-sulfonyl)amino]benzoyl}-N-(3-methylbutyl)piperidine-3-carboxamide--trifluoroacetic acid (1/1)
1-{4-[(4-methylbenzene-1-sulfonyl)amino]benzoyl}-N-(3-methylbutyl)piperidine-3-carboxamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | L444-0007 |
| Compound Name: | 1-{4-[(4-methylbenzene-1-sulfonyl)amino]benzoyl}-N-(3-methylbutyl)piperidine-3-carboxamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 585.64 |
| Molecular Formula: | C25 H33 N3 O4 S |
| Salt: | CF3COOH |
| Smiles: | CC(C)CCNC(C1CCCN(C1)C(c1ccc(cc1)NS(c1ccc(C)cc1)(=O)=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.6624 |
| logD: | 2.8123 |
| logSw: | -3.7548 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 81.996 |
| InChI Key: | ZTSFZLSSCQJEAT-NRFANRHFSA-N |