4-(4-{[N-(4-methylbenzene-1-sulfonyl)-N-(prop-2-en-1-yl)glycyl]amino}phenyl)-N-[3-(trifluoromethyl)phenyl]piperazine-1-carboxamide
Chemical Structure Depiction of
4-(4-{[N-(4-methylbenzene-1-sulfonyl)-N-(prop-2-en-1-yl)glycyl]amino}phenyl)-N-[3-(trifluoromethyl)phenyl]piperazine-1-carboxamide
4-(4-{[N-(4-methylbenzene-1-sulfonyl)-N-(prop-2-en-1-yl)glycyl]amino}phenyl)-N-[3-(trifluoromethyl)phenyl]piperazine-1-carboxamide
Compound characteristics
| Compound ID: | V008-7992 |
| Compound Name: | 4-(4-{[N-(4-methylbenzene-1-sulfonyl)-N-(prop-2-en-1-yl)glycyl]amino}phenyl)-N-[3-(trifluoromethyl)phenyl]piperazine-1-carboxamide |
| Molecular Weight: | 615.67 |
| Molecular Formula: | C30 H32 F3 N5 O4 S |
| Salt: | not_available |
| Smiles: | Cc1ccc(cc1)S(N(CC=C)CC(Nc1ccc(cc1)N1CCN(CC1)C(Nc1cccc(c1)C(F)(F)F)=O)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.7266 |
| logD: | 5.7204 |
| logSw: | -5.5331 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 83.471 |
| InChI Key: | RCZVIPHYSONCQA-UHFFFAOYSA-N |