2-[4-(furan-2-yl)-3H-1,5-benzodiazepin-2-yl]-4-methylphenol
Chemical Structure Depiction of
2-[4-(furan-2-yl)-3H-1,5-benzodiazepin-2-yl]-4-methylphenol
2-[4-(furan-2-yl)-3H-1,5-benzodiazepin-2-yl]-4-methylphenol
Compound characteristics
| Compound ID: | 4019-0063 |
| Compound Name: | 2-[4-(furan-2-yl)-3H-1,5-benzodiazepin-2-yl]-4-methylphenol |
| Molecular Weight: | 316.36 |
| Molecular Formula: | C20 H16 N2 O2 |
| Smiles: | Cc1ccc(c(c1)C1CC(c2ccco2)=Nc2ccccc2N=1)O |
| Stereo: | ACHIRAL |
| logP: | 4.3873 |
| logD: | 4.3647 |
| logSw: | -4.0312 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 42.897 |
| InChI Key: | KCFAAGAGYIRJOJ-UHFFFAOYSA-N |