2-(5-chloro-2-nitrophenyl)-4-methylphthalazin-1(2H)-one
Chemical Structure Depiction of
2-(5-chloro-2-nitrophenyl)-4-methylphthalazin-1(2H)-one
2-(5-chloro-2-nitrophenyl)-4-methylphthalazin-1(2H)-one
Compound characteristics
| Compound ID: | 2023-0309 |
| Compound Name: | 2-(5-chloro-2-nitrophenyl)-4-methylphthalazin-1(2H)-one |
| Molecular Weight: | 315.71 |
| Molecular Formula: | C15 H10 Cl N3 O3 |
| Smiles: | CC1c2ccccc2C(N(c2cc(ccc2[N+]([O-])=O)[Cl])N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3914 |
| logD: | 3.3914 |
| logSw: | -3.884 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 58 |
| InChI Key: | FENJTMDAMNDVCA-UHFFFAOYSA-N |