1-{4-[(4-bromobenzene-1-sulfonyl)amino]phenyl}-N-(butan-2-yl)cyclopropane-1-carboxamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
1-{4-[(4-bromobenzene-1-sulfonyl)amino]phenyl}-N-(butan-2-yl)cyclopropane-1-carboxamide--trifluoroacetic acid (1/1)
1-{4-[(4-bromobenzene-1-sulfonyl)amino]phenyl}-N-(butan-2-yl)cyclopropane-1-carboxamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | L164-0168 |
| Compound Name: | 1-{4-[(4-bromobenzene-1-sulfonyl)amino]phenyl}-N-(butan-2-yl)cyclopropane-1-carboxamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 565.4 |
| Molecular Formula: | C20 H23 Br N2 O3 S |
| Salt: | CF3COOH |
| Smiles: | CCC(C)NC(C1(CC1)c1ccc(cc1)NS(c1ccc(cc1)[Br])(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.0296 |
| logD: | 3.9982 |
| logSw: | -4.081 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 65.266 |
| InChI Key: | KECXZBVXAWMKOQ-AWEZNQCLSA-N |