N-cyclopentyl-1-(2-{[3-(trifluoromethyl)phenyl]carbamamido}ethyl)-1H-benzotriazole-5-carboxamide
Chemical Structure Depiction of
N-cyclopentyl-1-(2-{[3-(trifluoromethyl)phenyl]carbamamido}ethyl)-1H-benzotriazole-5-carboxamide
N-cyclopentyl-1-(2-{[3-(trifluoromethyl)phenyl]carbamamido}ethyl)-1H-benzotriazole-5-carboxamide
Compound characteristics
| Compound ID: | L693-0548 |
| Compound Name: | N-cyclopentyl-1-(2-{[3-(trifluoromethyl)phenyl]carbamamido}ethyl)-1H-benzotriazole-5-carboxamide |
| Molecular Weight: | 460.46 |
| Molecular Formula: | C22 H23 F3 N6 O2 |
| Smiles: | C1CCC(C1)NC(c1ccc2c(c1)nnn2CCNC(Nc1cccc(c1)C(F)(F)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7488 |
| logD: | 3.7487 |
| logSw: | -4.1208 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 83.886 |
| InChI Key: | WFFIYOXSDIYAGQ-UHFFFAOYSA-N |