2-(furan-2-yl)-4-(4-methoxyphenyl)-1H-1,3,5-benzotriazepine
Chemical Structure Depiction of
2-(furan-2-yl)-4-(4-methoxyphenyl)-1H-1,3,5-benzotriazepine
2-(furan-2-yl)-4-(4-methoxyphenyl)-1H-1,3,5-benzotriazepine
Compound characteristics
| Compound ID: | D165-0184 |
| Compound Name: | 2-(furan-2-yl)-4-(4-methoxyphenyl)-1H-1,3,5-benzotriazepine |
| Molecular Weight: | 317.35 |
| Molecular Formula: | C19 H15 N3 O2 |
| Smiles: | COc1ccc(cc1)C1N=C(c2ccco2)Nc2ccccc2N=1 |
| Stereo: | ACHIRAL |
| logP: | 3.5788 |
| logD: | 3.5787 |
| logSw: | -3.6677 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.597 |
| InChI Key: | RCKRFIDZOUMYNK-UHFFFAOYSA-N |