1-{4-[(4-methylbenzene-1-sulfonyl)amino]phenyl}-N-(2-phenylethyl)cyclopropane-1-carboxamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
1-{4-[(4-methylbenzene-1-sulfonyl)amino]phenyl}-N-(2-phenylethyl)cyclopropane-1-carboxamide--trifluoroacetic acid (1/1)
1-{4-[(4-methylbenzene-1-sulfonyl)amino]phenyl}-N-(2-phenylethyl)cyclopropane-1-carboxamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | L164-0341 |
| Compound Name: | 1-{4-[(4-methylbenzene-1-sulfonyl)amino]phenyl}-N-(2-phenylethyl)cyclopropane-1-carboxamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 548.58 |
| Molecular Formula: | C25 H26 N2 O3 S |
| Salt: | CF3COOH |
| Smiles: | Cc1ccc(cc1)S(Nc1ccc(cc1)C1(CC1)C(NCCc1ccccc1)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2464 |
| logD: | 4.2342 |
| logSw: | -4.24 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 65.395 |
| InChI Key: | HHZSDTXUWLLAJJ-UHFFFAOYSA-N |