7-chloro-2-(4-methoxyphenyl)-4-phenyl-1H-1,3,5-benzotriazepine
Chemical Structure Depiction of
7-chloro-2-(4-methoxyphenyl)-4-phenyl-1H-1,3,5-benzotriazepine
7-chloro-2-(4-methoxyphenyl)-4-phenyl-1H-1,3,5-benzotriazepine
Compound characteristics
| Compound ID: | D165-0141 |
| Compound Name: | 7-chloro-2-(4-methoxyphenyl)-4-phenyl-1H-1,3,5-benzotriazepine |
| Molecular Weight: | 361.83 |
| Molecular Formula: | C21 H16 Cl N3 O |
| Smiles: | COc1ccc(cc1)C1Nc2ccc(cc2N=C(c2ccccc2)N=1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 5.0179 |
| logD: | 5.0172 |
| logSw: | -5.2409 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.019 |
| InChI Key: | FIEAYJZXBLRZCK-UHFFFAOYSA-N |