1-(4-{[4-(2-methylpropyl)benzene-1-sulfonyl]amino}phenyl)-N-(propan-2-yl)cyclopropane-1-carboxamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
1-(4-{[4-(2-methylpropyl)benzene-1-sulfonyl]amino}phenyl)-N-(propan-2-yl)cyclopropane-1-carboxamide--trifluoroacetic acid (1/1)
1-(4-{[4-(2-methylpropyl)benzene-1-sulfonyl]amino}phenyl)-N-(propan-2-yl)cyclopropane-1-carboxamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | L164-0116 |
| Compound Name: | 1-(4-{[4-(2-methylpropyl)benzene-1-sulfonyl]amino}phenyl)-N-(propan-2-yl)cyclopropane-1-carboxamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 528.59 |
| Molecular Formula: | C23 H30 N2 O3 S |
| Salt: | CF3COOH |
| Smiles: | CC(C)Cc1ccc(cc1)S(Nc1ccc(cc1)C1(CC1)C(NC(C)C)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7503 |
| logD: | 4.7381 |
| logSw: | -4.4263 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 64.799 |
| InChI Key: | UDLOXEODWAIUCX-UHFFFAOYSA-N |