N-[(2-chloro-4-fluorophenyl)methyl]-1-[2-(morpholin-4-yl)ethyl]-1H-benzotriazole-5-carboxamide
Chemical Structure Depiction of
N-[(2-chloro-4-fluorophenyl)methyl]-1-[2-(morpholin-4-yl)ethyl]-1H-benzotriazole-5-carboxamide
N-[(2-chloro-4-fluorophenyl)methyl]-1-[2-(morpholin-4-yl)ethyl]-1H-benzotriazole-5-carboxamide
Compound characteristics
| Compound ID: | P769-0540 |
| Compound Name: | N-[(2-chloro-4-fluorophenyl)methyl]-1-[2-(morpholin-4-yl)ethyl]-1H-benzotriazole-5-carboxamide |
| Molecular Weight: | 417.87 |
| Molecular Formula: | C20 H21 Cl F N5 O2 |
| Smiles: | C(c1ccc(cc1[Cl])F)NC(c1ccc2c(c1)nnn2CCN1CCOCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3554 |
| logD: | 2.3517 |
| logSw: | -3.4156 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.947 |
| InChI Key: | LZORXUDNJNFDLN-UHFFFAOYSA-N |