2-[4-(azepan-1-yl)-1-oxophthalazin-2(1H)-yl]-N-[(4-methylphenyl)methyl]acetamide
Chemical Structure Depiction of
2-[4-(azepan-1-yl)-1-oxophthalazin-2(1H)-yl]-N-[(4-methylphenyl)methyl]acetamide
2-[4-(azepan-1-yl)-1-oxophthalazin-2(1H)-yl]-N-[(4-methylphenyl)methyl]acetamide
Compound characteristics
| Compound ID: | M183-0786 |
| Compound Name: | 2-[4-(azepan-1-yl)-1-oxophthalazin-2(1H)-yl]-N-[(4-methylphenyl)methyl]acetamide |
| Molecular Weight: | 404.51 |
| Molecular Formula: | C24 H28 N4 O2 |
| Smiles: | Cc1ccc(CNC(CN2C(c3ccccc3C(=N2)N2CCCCCC2)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.6098 |
| logD: | 3.6098 |
| logSw: | -3.5457 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.04 |
| InChI Key: | JVLVFRKTHBSZBC-UHFFFAOYSA-N |