2-[4-(4-tert-butylphenyl)-3H-1,5-benzodiazepin-2-yl]-4-methylphenol
Chemical Structure Depiction of
2-[4-(4-tert-butylphenyl)-3H-1,5-benzodiazepin-2-yl]-4-methylphenol
2-[4-(4-tert-butylphenyl)-3H-1,5-benzodiazepin-2-yl]-4-methylphenol
Compound characteristics
| Compound ID: | 4019-0022 |
| Compound Name: | 2-[4-(4-tert-butylphenyl)-3H-1,5-benzodiazepin-2-yl]-4-methylphenol |
| Molecular Weight: | 382.5 |
| Molecular Formula: | C26 H26 N2 O |
| Smiles: | Cc1ccc(c(c1)C1CC(c2ccc(cc2)C(C)(C)C)=Nc2ccccc2N=1)O |
| Stereo: | ACHIRAL |
| logP: | 7.0827 |
| logD: | 7.0523 |
| logSw: | -5.6718 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 34.318 |
| InChI Key: | XCLJPBJDQJDOCE-UHFFFAOYSA-N |