N-[(4-chlorophenyl)methyl]-1-[3-(4-methylanilino)-3-oxopropyl]-1H-benzotriazole-5-carboxamide
Chemical Structure Depiction of
N-[(4-chlorophenyl)methyl]-1-[3-(4-methylanilino)-3-oxopropyl]-1H-benzotriazole-5-carboxamide
N-[(4-chlorophenyl)methyl]-1-[3-(4-methylanilino)-3-oxopropyl]-1H-benzotriazole-5-carboxamide
Compound characteristics
| Compound ID: | M281-4855 |
| Compound Name: | N-[(4-chlorophenyl)methyl]-1-[3-(4-methylanilino)-3-oxopropyl]-1H-benzotriazole-5-carboxamide |
| Molecular Weight: | 447.92 |
| Molecular Formula: | C24 H22 Cl N5 O2 |
| Smiles: | Cc1ccc(cc1)NC(CCn1c2ccc(cc2nn1)C(NCc1ccc(cc1)[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8287 |
| logD: | 3.8286 |
| logSw: | -4.436 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 73.205 |
| InChI Key: | OJUZFTOWYDRIQX-UHFFFAOYSA-N |