N-benzyl-1-{4-[(4-ethylbenzene-1-sulfonyl)amino]phenyl}cyclopropane-1-carboxamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
N-benzyl-1-{4-[(4-ethylbenzene-1-sulfonyl)amino]phenyl}cyclopropane-1-carboxamide--trifluoroacetic acid (1/1)
N-benzyl-1-{4-[(4-ethylbenzene-1-sulfonyl)amino]phenyl}cyclopropane-1-carboxamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | L164-0153 |
| Compound Name: | N-benzyl-1-{4-[(4-ethylbenzene-1-sulfonyl)amino]phenyl}cyclopropane-1-carboxamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 548.58 |
| Molecular Formula: | C25 H26 N2 O3 S |
| Salt: | CF3COOH |
| Smiles: | CCc1ccc(cc1)S(Nc1ccc(cc1)C1(CC1)C(NCc1ccccc1)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8201 |
| logD: | 4.8079 |
| logSw: | -4.5993 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 65.553 |
| InChI Key: | BCVGDOCDGLIFSH-UHFFFAOYSA-N |