N-[(2-chlorophenyl)methyl]-1-[2-(dimethylamino)ethyl]-1H-benzotriazole-5-carboxamide
Chemical Structure Depiction of
N-[(2-chlorophenyl)methyl]-1-[2-(dimethylamino)ethyl]-1H-benzotriazole-5-carboxamide
N-[(2-chlorophenyl)methyl]-1-[2-(dimethylamino)ethyl]-1H-benzotriazole-5-carboxamide
Compound characteristics
| Compound ID: | P769-0073 |
| Compound Name: | N-[(2-chlorophenyl)methyl]-1-[2-(dimethylamino)ethyl]-1H-benzotriazole-5-carboxamide |
| Molecular Weight: | 357.84 |
| Molecular Formula: | C18 H20 Cl N5 O |
| Smiles: | CN(C)CCn1c2ccc(cc2nn1)C(NCc1ccccc1[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 2.4512 |
| logD: | 2.0498 |
| logSw: | -3.4583 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.193 |
| InChI Key: | HBEKHMVVMQYTDI-UHFFFAOYSA-N |