N-(1,3-benzothiazol-2-yl)-1-[(2-methylphenyl)methyl]-1H-benzotriazole-5-carboxamide
Chemical Structure Depiction of
N-(1,3-benzothiazol-2-yl)-1-[(2-methylphenyl)methyl]-1H-benzotriazole-5-carboxamide
N-(1,3-benzothiazol-2-yl)-1-[(2-methylphenyl)methyl]-1H-benzotriazole-5-carboxamide
Compound characteristics
| Compound ID: | L455-0204 |
| Compound Name: | N-(1,3-benzothiazol-2-yl)-1-[(2-methylphenyl)methyl]-1H-benzotriazole-5-carboxamide |
| Molecular Weight: | 399.47 |
| Molecular Formula: | C22 H17 N5 O S |
| Smiles: | Cc1ccccc1Cn1c2ccc(cc2nn1)C(Nc1nc2ccccc2s1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0573 |
| logD: | 5.0553 |
| logSw: | -4.6871 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.517 |
| InChI Key: | CGEQURYOCZPAEG-UHFFFAOYSA-N |