N-(3-chlorophenyl)-1-[2-(dimethylamino)ethyl]-1H-benzotriazole-5-carboxamide
Chemical Structure Depiction of
N-(3-chlorophenyl)-1-[2-(dimethylamino)ethyl]-1H-benzotriazole-5-carboxamide
N-(3-chlorophenyl)-1-[2-(dimethylamino)ethyl]-1H-benzotriazole-5-carboxamide
Compound characteristics
| Compound ID: | P769-0071 |
| Compound Name: | N-(3-chlorophenyl)-1-[2-(dimethylamino)ethyl]-1H-benzotriazole-5-carboxamide |
| Molecular Weight: | 343.81 |
| Molecular Formula: | C17 H18 Cl N5 O |
| Smiles: | CN(C)CCn1c2ccc(cc2nn1)C(Nc1cccc(c1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 2.7568 |
| logD: | 2.3554 |
| logSw: | -3.658 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.871 |
| InChI Key: | QLJMCQQCNGMYLQ-UHFFFAOYSA-N |