2-(4-chlorophenyl)-7-ethyl-4-(4-methoxyphenyl)-1H-1,3,5-benzotriazepine
Chemical Structure Depiction of
2-(4-chlorophenyl)-7-ethyl-4-(4-methoxyphenyl)-1H-1,3,5-benzotriazepine
2-(4-chlorophenyl)-7-ethyl-4-(4-methoxyphenyl)-1H-1,3,5-benzotriazepine
Compound characteristics
| Compound ID: | D165-0152 |
| Compound Name: | 2-(4-chlorophenyl)-7-ethyl-4-(4-methoxyphenyl)-1H-1,3,5-benzotriazepine |
| Molecular Weight: | 389.88 |
| Molecular Formula: | C23 H20 Cl N3 O |
| Smiles: | CCc1ccc2c(c1)N=C(c1ccc(cc1)OC)N=C(c1ccc(cc1)[Cl])N2 |
| Stereo: | ACHIRAL |
| logP: | 6.0669 |
| logD: | 6.0641 |
| logSw: | -6.3429 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.019 |
| InChI Key: | QTBMPVTVFVVAEQ-UHFFFAOYSA-N |