4-(4-{[N-(benzenesulfonyl)-N-(prop-2-en-1-yl)glycyl]amino}phenyl)-N-[3-(trifluoromethyl)phenyl]piperazine-1-carboxamide
Chemical Structure Depiction of
4-(4-{[N-(benzenesulfonyl)-N-(prop-2-en-1-yl)glycyl]amino}phenyl)-N-[3-(trifluoromethyl)phenyl]piperazine-1-carboxamide
4-(4-{[N-(benzenesulfonyl)-N-(prop-2-en-1-yl)glycyl]amino}phenyl)-N-[3-(trifluoromethyl)phenyl]piperazine-1-carboxamide
Compound characteristics
| Compound ID: | V024-6604 |
| Compound Name: | 4-(4-{[N-(benzenesulfonyl)-N-(prop-2-en-1-yl)glycyl]amino}phenyl)-N-[3-(trifluoromethyl)phenyl]piperazine-1-carboxamide |
| Molecular Weight: | 601.65 |
| Molecular Formula: | C29 H30 F3 N5 O4 S |
| Salt: | not_available |
| Smiles: | C=CCN(CC(Nc1ccc(cc1)N1CCN(CC1)C(Nc1cccc(c1)C(F)(F)F)=O)=O)S(c1ccccc1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1182 |
| logD: | 5.1119 |
| logSw: | -5.3794 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 83.471 |
| InChI Key: | NDNZQUWSFZZRHC-UHFFFAOYSA-N |