N-[(3-methylphenyl)methyl]-1-[2-(morpholin-4-yl)ethyl]-1H-benzotriazole-5-carboxamide
Chemical Structure Depiction of
N-[(3-methylphenyl)methyl]-1-[2-(morpholin-4-yl)ethyl]-1H-benzotriazole-5-carboxamide
N-[(3-methylphenyl)methyl]-1-[2-(morpholin-4-yl)ethyl]-1H-benzotriazole-5-carboxamide
Compound characteristics
| Compound ID: | P769-0553 |
| Compound Name: | N-[(3-methylphenyl)methyl]-1-[2-(morpholin-4-yl)ethyl]-1H-benzotriazole-5-carboxamide |
| Molecular Weight: | 379.46 |
| Molecular Formula: | C21 H25 N5 O2 |
| Smiles: | Cc1cccc(CNC(c2ccc3c(c2)nnn3CCN2CCOCC2)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 2.021 |
| logD: | 2.0173 |
| logSw: | -2.3405 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.947 |
| InChI Key: | PKQRIBPADFASHV-UHFFFAOYSA-N |