2-[4-(3-nitrophenyl)-3H-1,5-benzodiazepin-2-yl]phenol
Chemical Structure Depiction of
2-[4-(3-nitrophenyl)-3H-1,5-benzodiazepin-2-yl]phenol
2-[4-(3-nitrophenyl)-3H-1,5-benzodiazepin-2-yl]phenol
Compound characteristics
| Compound ID: | 4019-0010 |
| Compound Name: | 2-[4-(3-nitrophenyl)-3H-1,5-benzodiazepin-2-yl]phenol |
| Molecular Weight: | 357.37 |
| Molecular Formula: | C21 H15 N3 O3 |
| Smiles: | C1C(c2cccc(c2)[N+]([O-])=O)=Nc2ccccc2N=C1c1ccccc1O |
| Stereo: | ACHIRAL |
| logP: | 4.7998 |
| logD: | 4.7426 |
| logSw: | -4.322 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.7 |
| InChI Key: | VFMCEPLKOYSGTH-UHFFFAOYSA-N |