N-butyl-1-{4-[(4-ethoxybenzene-1-sulfonyl)amino]phenyl}cyclopropane-1-carboxamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
N-butyl-1-{4-[(4-ethoxybenzene-1-sulfonyl)amino]phenyl}cyclopropane-1-carboxamide--trifluoroacetic acid (1/1)
N-butyl-1-{4-[(4-ethoxybenzene-1-sulfonyl)amino]phenyl}cyclopropane-1-carboxamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | L164-0835 |
| Compound Name: | N-butyl-1-{4-[(4-ethoxybenzene-1-sulfonyl)amino]phenyl}cyclopropane-1-carboxamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 530.56 |
| Molecular Formula: | C22 H28 N2 O4 S |
| Salt: | CF3COOH |
| Smiles: | CCCCNC(C1(CC1)c1ccc(cc1)NS(c1ccc(cc1)OCC)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.071 |
| logD: | 4.0697 |
| logSw: | -3.9525 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 72.79 |
| InChI Key: | IWRNRIUKDWNPGL-UHFFFAOYSA-N |