2-[4-(3-methylphenyl)-3H-1,5-benzodiazepin-2-yl]phenol
Chemical Structure Depiction of
2-[4-(3-methylphenyl)-3H-1,5-benzodiazepin-2-yl]phenol
2-[4-(3-methylphenyl)-3H-1,5-benzodiazepin-2-yl]phenol
Compound characteristics
| Compound ID: | 4019-0002 |
| Compound Name: | 2-[4-(3-methylphenyl)-3H-1,5-benzodiazepin-2-yl]phenol |
| Molecular Weight: | 326.4 |
| Molecular Formula: | C22 H18 N2 O |
| Smiles: | Cc1cccc(c1)C1CC(c2ccccc2O)=Nc2ccccc2N=1 |
| Stereo: | ACHIRAL |
| logP: | 5.225 |
| logD: | 5.1674 |
| logSw: | -4.9943 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 34.318 |
| InChI Key: | CQFBMUWDOBLUKE-UHFFFAOYSA-N |