1-{4-[(3-chloro-4-methylbenzene-1-sulfonyl)amino]phenyl}-N-(3-methoxypropyl)cyclopropane-1-carboxamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
1-{4-[(3-chloro-4-methylbenzene-1-sulfonyl)amino]phenyl}-N-(3-methoxypropyl)cyclopropane-1-carboxamide--trifluoroacetic acid (1/1)
1-{4-[(3-chloro-4-methylbenzene-1-sulfonyl)amino]phenyl}-N-(3-methoxypropyl)cyclopropane-1-carboxamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | L164-0540 |
| Compound Name: | 1-{4-[(3-chloro-4-methylbenzene-1-sulfonyl)amino]phenyl}-N-(3-methoxypropyl)cyclopropane-1-carboxamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 550.98 |
| Molecular Formula: | C21 H25 Cl N2 O4 S |
| Salt: | CF3COOH |
| Smiles: | Cc1ccc(cc1[Cl])S(Nc1ccc(cc1)C1(CC1)C(NCCCOC)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6416 |
| logD: | 3.6294 |
| logSw: | -4.0154 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 74.008 |
| InChI Key: | QOKNPVHVRQFIIU-UHFFFAOYSA-N |