1-{4-[(3,4-dimethoxybenzene-1-sulfonyl)amino]phenyl}-N-(2-methoxyethyl)cyclopropane-1-carboxamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
1-{4-[(3,4-dimethoxybenzene-1-sulfonyl)amino]phenyl}-N-(2-methoxyethyl)cyclopropane-1-carboxamide--trifluoroacetic acid (1/1)
1-{4-[(3,4-dimethoxybenzene-1-sulfonyl)amino]phenyl}-N-(2-methoxyethyl)cyclopropane-1-carboxamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | L164-0378 |
| Compound Name: | 1-{4-[(3,4-dimethoxybenzene-1-sulfonyl)amino]phenyl}-N-(2-methoxyethyl)cyclopropane-1-carboxamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 548.53 |
| Molecular Formula: | C21 H26 N2 O6 S |
| Salt: | CF3COOH |
| Smiles: | COCCNC(C1(CC1)c1ccc(cc1)NS(c1ccc(c(c1)OC)OC)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.8924 |
| logD: | 1.892 |
| logSw: | -2.7804 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 89.269 |
| InChI Key: | HQIJWKGRTGYGLR-UHFFFAOYSA-N |