2-[4-(4-bromophenyl)-3H-1,5-benzodiazepin-2-yl]-4-chlorophenol
Chemical Structure Depiction of
2-[4-(4-bromophenyl)-3H-1,5-benzodiazepin-2-yl]-4-chlorophenol
2-[4-(4-bromophenyl)-3H-1,5-benzodiazepin-2-yl]-4-chlorophenol
Compound characteristics
| Compound ID: | 4019-0045 |
| Compound Name: | 2-[4-(4-bromophenyl)-3H-1,5-benzodiazepin-2-yl]-4-chlorophenol |
| Molecular Weight: | 425.71 |
| Molecular Formula: | C21 H14 Br Cl N2 O |
| Smiles: | C1C(c2ccc(cc2)[Br])=Nc2ccccc2N=C1c1cc(ccc1O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 6.3965 |
| logD: | 6.2813 |
| logSw: | -6.3616 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 34.318 |
| InChI Key: | NRJXEOGVNBSVFR-UHFFFAOYSA-N |