4-{4-[(2-hydroxypropyl)amino]-3-nitrophenyl}phthalazin-1(2H)-one
Chemical Structure Depiction of
4-{4-[(2-hydroxypropyl)amino]-3-nitrophenyl}phthalazin-1(2H)-one
4-{4-[(2-hydroxypropyl)amino]-3-nitrophenyl}phthalazin-1(2H)-one
Compound characteristics
| Compound ID: | 6216-0044 |
| Compound Name: | 4-{4-[(2-hydroxypropyl)amino]-3-nitrophenyl}phthalazin-1(2H)-one |
| Molecular Weight: | 340.34 |
| Molecular Formula: | C17 H16 N4 O4 |
| Smiles: | CC(CNc1ccc(cc1[N+]([O-])=O)C1c2ccccc2C(NN=1)=O)O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.9001 |
| logD: | 1.8999 |
| logSw: | -2.8784 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 95.725 |
| InChI Key: | MSMUMJGQQLOQDN-JTQLQIEISA-N |