5-(4-chlorophenyl)-7-ethoxy-2-phenyl-3H-1,3,4-benzotriazepine
Chemical Structure Depiction of
5-(4-chlorophenyl)-7-ethoxy-2-phenyl-3H-1,3,4-benzotriazepine
5-(4-chlorophenyl)-7-ethoxy-2-phenyl-3H-1,3,4-benzotriazepine
Compound characteristics
| Compound ID: | 7652-0060 |
| Compound Name: | 5-(4-chlorophenyl)-7-ethoxy-2-phenyl-3H-1,3,4-benzotriazepine |
| Molecular Weight: | 375.86 |
| Molecular Formula: | C22 H18 Cl N3 O |
| Smiles: | CCOc1ccc2c(c1)C(c1ccc(cc1)[Cl])=NNC(c1ccccc1)=N2 |
| Stereo: | ACHIRAL |
| logP: | 5.4783 |
| logD: | 4.4946 |
| logSw: | -5.9363 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.066 |
| InChI Key: | RVDWCOMDVUFUBI-UHFFFAOYSA-N |