1-{4-[(2,5-dimethoxybenzene-1-sulfonyl)amino]phenyl}-N-(2-methylpropyl)cyclopropane-1-carboxamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
1-{4-[(2,5-dimethoxybenzene-1-sulfonyl)amino]phenyl}-N-(2-methylpropyl)cyclopropane-1-carboxamide--trifluoroacetic acid (1/1)
1-{4-[(2,5-dimethoxybenzene-1-sulfonyl)amino]phenyl}-N-(2-methylpropyl)cyclopropane-1-carboxamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | L164-0687 |
| Compound Name: | 1-{4-[(2,5-dimethoxybenzene-1-sulfonyl)amino]phenyl}-N-(2-methylpropyl)cyclopropane-1-carboxamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 546.56 |
| Molecular Formula: | C22 H28 N2 O5 S |
| Salt: | CF3COOH |
| Smiles: | CC(C)CNC(C1(CC1)c1ccc(cc1)NS(c1cc(ccc1OC)OC)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3011 |
| logD: | 3.2972 |
| logSw: | -3.7646 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 80.999 |
| InChI Key: | MQKBPOYOWVKNPO-UHFFFAOYSA-N |