N-benzyl-1-{4-[(4-methoxybenzene-1-sulfonyl)amino]phenyl}cyclopropane-1-carboxamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
N-benzyl-1-{4-[(4-methoxybenzene-1-sulfonyl)amino]phenyl}cyclopropane-1-carboxamide--trifluoroacetic acid (1/1)
N-benzyl-1-{4-[(4-methoxybenzene-1-sulfonyl)amino]phenyl}cyclopropane-1-carboxamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | L164-0136 |
| Compound Name: | N-benzyl-1-{4-[(4-methoxybenzene-1-sulfonyl)amino]phenyl}cyclopropane-1-carboxamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 550.55 |
| Molecular Formula: | C24 H24 N2 O4 S |
| Salt: | CF3COOH |
| Smiles: | COc1ccc(cc1)S(Nc1ccc(cc1)C1(CC1)C(NCc1ccccc1)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8719 |
| logD: | 3.8706 |
| logSw: | -4.1634 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 73.097 |
| InChI Key: | HPDUXEQARWVBIB-UHFFFAOYSA-N |