1-{4-[(3-methoxybenzene-1-sulfonyl)amino]benzoyl}-N-(3-methoxypropyl)piperidine-4-carboxamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
1-{4-[(3-methoxybenzene-1-sulfonyl)amino]benzoyl}-N-(3-methoxypropyl)piperidine-4-carboxamide--trifluoroacetic acid (1/1)
1-{4-[(3-methoxybenzene-1-sulfonyl)amino]benzoyl}-N-(3-methoxypropyl)piperidine-4-carboxamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | L445-0202 |
| Compound Name: | 1-{4-[(3-methoxybenzene-1-sulfonyl)amino]benzoyl}-N-(3-methoxypropyl)piperidine-4-carboxamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 603.61 |
| Molecular Formula: | C24 H31 N3 O6 S |
| Salt: | CF3COOH |
| Smiles: | COCCCNC(C1CCN(CC1)C(c1ccc(cc1)NS(c1cccc(c1)OC)(=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.6983 |
| logD: | 1.2341 |
| logSw: | -2.6568 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 97.949 |
| InChI Key: | OUUMUEPRBCSWJW-UHFFFAOYSA-N |