1-{4-[(2,5-dimethoxybenzene-1-sulfonyl)amino]phenyl}-N-(propan-2-yl)cyclopropane-1-carboxamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
1-{4-[(2,5-dimethoxybenzene-1-sulfonyl)amino]phenyl}-N-(propan-2-yl)cyclopropane-1-carboxamide--trifluoroacetic acid (1/1)
1-{4-[(2,5-dimethoxybenzene-1-sulfonyl)amino]phenyl}-N-(propan-2-yl)cyclopropane-1-carboxamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | L164-0108 |
| Compound Name: | 1-{4-[(2,5-dimethoxybenzene-1-sulfonyl)amino]phenyl}-N-(propan-2-yl)cyclopropane-1-carboxamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 532.53 |
| Molecular Formula: | C21 H26 N2 O5 S |
| Salt: | CF3COOH |
| Smiles: | CC(C)NC(C1(CC1)c1ccc(cc1)NS(c1cc(ccc1OC)OC)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8963 |
| logD: | 2.8924 |
| logSw: | -3.6173 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 79.973 |
| InChI Key: | CGQRPHCCKLZMGG-UHFFFAOYSA-N |