N-(3-methylbutyl)-1-{4-[(4-propylbenzene-1-sulfonyl)amino]phenyl}cyclopropane-1-carboxamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
N-(3-methylbutyl)-1-{4-[(4-propylbenzene-1-sulfonyl)amino]phenyl}cyclopropane-1-carboxamide--trifluoroacetic acid (1/1)
N-(3-methylbutyl)-1-{4-[(4-propylbenzene-1-sulfonyl)amino]phenyl}cyclopropane-1-carboxamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | L164-0032 |
| Compound Name: | N-(3-methylbutyl)-1-{4-[(4-propylbenzene-1-sulfonyl)amino]phenyl}cyclopropane-1-carboxamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 542.62 |
| Molecular Formula: | C24 H32 N2 O3 S |
| Salt: | CF3COOH |
| Smiles: | CCCc1ccc(cc1)S(Nc1ccc(cc1)C1(CC1)C(NCCC(C)C)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.3212 |
| logD: | 5.309 |
| logSw: | -5.3614 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 65.666 |
| InChI Key: | XRTUWWAYLHTLJO-UHFFFAOYSA-N |