N,N-dimethyl-1-(2-{[3-(trifluoromethyl)phenyl]carbamamido}ethyl)-1H-benzotriazole-5-carboxamide
Chemical Structure Depiction of
N,N-dimethyl-1-(2-{[3-(trifluoromethyl)phenyl]carbamamido}ethyl)-1H-benzotriazole-5-carboxamide
N,N-dimethyl-1-(2-{[3-(trifluoromethyl)phenyl]carbamamido}ethyl)-1H-benzotriazole-5-carboxamide
Compound characteristics
| Compound ID: | L693-0296 |
| Compound Name: | N,N-dimethyl-1-(2-{[3-(trifluoromethyl)phenyl]carbamamido}ethyl)-1H-benzotriazole-5-carboxamide |
| Molecular Weight: | 420.39 |
| Molecular Formula: | C19 H19 F3 N6 O2 |
| Smiles: | CN(C)C(c1ccc2c(c1)nnn2CCNC(Nc1cccc(c1)C(F)(F)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.8871 |
| logD: | 1.8871 |
| logSw: | -2.6765 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 75.382 |
| InChI Key: | XVNLFBYSAYDXLD-UHFFFAOYSA-N |