N-[(3,4-dimethylphenyl)methyl]-1-[2-(morpholin-4-yl)ethyl]-1H-benzotriazole-5-carboxamide
Chemical Structure Depiction of
N-[(3,4-dimethylphenyl)methyl]-1-[2-(morpholin-4-yl)ethyl]-1H-benzotriazole-5-carboxamide
N-[(3,4-dimethylphenyl)methyl]-1-[2-(morpholin-4-yl)ethyl]-1H-benzotriazole-5-carboxamide
Compound characteristics
| Compound ID: | P769-0555 |
| Compound Name: | N-[(3,4-dimethylphenyl)methyl]-1-[2-(morpholin-4-yl)ethyl]-1H-benzotriazole-5-carboxamide |
| Molecular Weight: | 393.49 |
| Molecular Formula: | C22 H27 N5 O2 |
| Smiles: | Cc1ccc(CNC(c2ccc3c(c2)nnn3CCN2CCOCC2)=O)cc1C |
| Stereo: | ACHIRAL |
| logP: | 2.3523 |
| logD: | 2.3486 |
| logSw: | -2.6418 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.947 |
| InChI Key: | LPGZAWMHMABKOD-UHFFFAOYSA-N |