N-{3-[ethyl(3-methylphenyl)amino]propyl}-2-{1-oxo-4-[(pyridin-4-yl)methyl]phthalazin-2(1H)-yl}acetamide
Chemical Structure Depiction of
N-{3-[ethyl(3-methylphenyl)amino]propyl}-2-{1-oxo-4-[(pyridin-4-yl)methyl]phthalazin-2(1H)-yl}acetamide
N-{3-[ethyl(3-methylphenyl)amino]propyl}-2-{1-oxo-4-[(pyridin-4-yl)methyl]phthalazin-2(1H)-yl}acetamide
Compound characteristics
| Compound ID: | C696-0789 |
| Compound Name: | N-{3-[ethyl(3-methylphenyl)amino]propyl}-2-{1-oxo-4-[(pyridin-4-yl)methyl]phthalazin-2(1H)-yl}acetamide |
| Molecular Weight: | 469.59 |
| Molecular Formula: | C28 H31 N5 O2 |
| Smiles: | CCN(CCCNC(CN1C(c2ccccc2C(Cc2ccncc2)=N1)=O)=O)c1cccc(C)c1 |
| Stereo: | ACHIRAL |
| logP: | 3.0088 |
| logD: | 2.9765 |
| logSw: | -3.2681 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.83 |
| InChI Key: | BFWULFQEJVITNF-UHFFFAOYSA-N |