4-(3,4-dimethylphenyl)-2-[5-nitro-2-(pyrrolidin-1-yl)phenyl]phthalazin-1(2H)-one
Chemical Structure Depiction of
4-(3,4-dimethylphenyl)-2-[5-nitro-2-(pyrrolidin-1-yl)phenyl]phthalazin-1(2H)-one
4-(3,4-dimethylphenyl)-2-[5-nitro-2-(pyrrolidin-1-yl)phenyl]phthalazin-1(2H)-one
Compound characteristics
| Compound ID: | 4265-2124 |
| Compound Name: | 4-(3,4-dimethylphenyl)-2-[5-nitro-2-(pyrrolidin-1-yl)phenyl]phthalazin-1(2H)-one |
| Molecular Weight: | 440.5 |
| Molecular Formula: | C26 H24 N4 O3 |
| Smiles: | Cc1ccc(cc1C)C1c2ccccc2C(N(c2cc(ccc2N2CCCC2)[N+]([O-])=O)N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.954 |
| logD: | 5.954 |
| logSw: | -5.4721 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 62.374 |
| InChI Key: | RPPYDZGXBHJLSC-UHFFFAOYSA-N |