N-(2-chloro-4-fluorophenyl)-1-[2-(morpholin-4-yl)ethyl]-1H-benzotriazole-5-carboxamide
Chemical Structure Depiction of
N-(2-chloro-4-fluorophenyl)-1-[2-(morpholin-4-yl)ethyl]-1H-benzotriazole-5-carboxamide
N-(2-chloro-4-fluorophenyl)-1-[2-(morpholin-4-yl)ethyl]-1H-benzotriazole-5-carboxamide
Compound characteristics
| Compound ID: | P769-0517 |
| Compound Name: | N-(2-chloro-4-fluorophenyl)-1-[2-(morpholin-4-yl)ethyl]-1H-benzotriazole-5-carboxamide |
| Molecular Weight: | 403.84 |
| Molecular Formula: | C19 H19 Cl F N5 O2 |
| Smiles: | C(Cn1c2ccc(cc2nn1)C(Nc1ccc(cc1[Cl])F)=O)N1CCOCC1 |
| Stereo: | ACHIRAL |
| logP: | 2.298 |
| logD: | 2.016 |
| logSw: | -3.3984 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.927 |
| InChI Key: | VTMBJBDZURPTSQ-UHFFFAOYSA-N |