N-(3-chloro-4-fluorophenyl)-2-{1-oxo-4-[(pyridin-4-yl)methyl]phthalazin-2(1H)-yl}acetamide
Chemical Structure Depiction of
N-(3-chloro-4-fluorophenyl)-2-{1-oxo-4-[(pyridin-4-yl)methyl]phthalazin-2(1H)-yl}acetamide
N-(3-chloro-4-fluorophenyl)-2-{1-oxo-4-[(pyridin-4-yl)methyl]phthalazin-2(1H)-yl}acetamide
Compound characteristics
| Compound ID: | C696-0702 |
| Compound Name: | N-(3-chloro-4-fluorophenyl)-2-{1-oxo-4-[(pyridin-4-yl)methyl]phthalazin-2(1H)-yl}acetamide |
| Molecular Weight: | 422.84 |
| Molecular Formula: | C22 H16 Cl F N4 O2 |
| Smiles: | C(C1c2ccccc2C(N(CC(Nc2ccc(c(c2)[Cl])F)=O)N=1)=O)c1ccncc1 |
| Stereo: | ACHIRAL |
| logP: | 3.1712 |
| logD: | 3.1634 |
| logSw: | -3.8377 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.676 |
| InChI Key: | BIXDECNFIJHHFH-UHFFFAOYSA-N |