N-methyl-1-(4-{[4-(2-methylpropyl)benzene-1-sulfonyl]amino}phenyl)cyclopropane-1-carboxamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
N-methyl-1-(4-{[4-(2-methylpropyl)benzene-1-sulfonyl]amino}phenyl)cyclopropane-1-carboxamide--trifluoroacetic acid (1/1)
N-methyl-1-(4-{[4-(2-methylpropyl)benzene-1-sulfonyl]amino}phenyl)cyclopropane-1-carboxamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | L164-0864 |
| Compound Name: | N-methyl-1-(4-{[4-(2-methylpropyl)benzene-1-sulfonyl]amino}phenyl)cyclopropane-1-carboxamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 500.54 |
| Molecular Formula: | C21 H26 N2 O3 S |
| Salt: | CF3COOH |
| Smiles: | CC(C)Cc1ccc(cc1)S(Nc1ccc(cc1)C1(CC1)C(NC)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9138 |
| logD: | 3.9016 |
| logSw: | -4.0805 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 65.975 |
| InChI Key: | VSSPDEVYKFOXIF-UHFFFAOYSA-N |