1-{4-[(2,5-dimethoxybenzene-1-sulfonyl)amino]phenyl}-N-(3-phenylpropyl)cyclopropane-1-carboxamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
1-{4-[(2,5-dimethoxybenzene-1-sulfonyl)amino]phenyl}-N-(3-phenylpropyl)cyclopropane-1-carboxamide--trifluoroacetic acid (1/1)
1-{4-[(2,5-dimethoxybenzene-1-sulfonyl)amino]phenyl}-N-(3-phenylpropyl)cyclopropane-1-carboxamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | L164-0720 |
| Compound Name: | 1-{4-[(2,5-dimethoxybenzene-1-sulfonyl)amino]phenyl}-N-(3-phenylpropyl)cyclopropane-1-carboxamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 608.63 |
| Molecular Formula: | C27 H30 N2 O5 S |
| Salt: | CF3COOH |
| Smiles: | COc1ccc(c(c1)S(Nc1ccc(cc1)C1(CC1)C(NCCCc1ccccc1)=O)(=O)=O)OC |
| Stereo: | ACHIRAL |
| logP: | 4.6259 |
| logD: | 4.622 |
| logSw: | -4.4992 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 80.569 |
| InChI Key: | WMBZPVCRHXYBPI-UHFFFAOYSA-N |