N-[1-(2-{[2-(azepan-1-yl)ethyl]amino}-2-oxoethyl)-6-methyl-2-oxo-1,2-dihydropyridin-3-yl]-4-methylbenzamide
Chemical Structure Depiction of
N-[1-(2-{[2-(azepan-1-yl)ethyl]amino}-2-oxoethyl)-6-methyl-2-oxo-1,2-dihydropyridin-3-yl]-4-methylbenzamide
N-[1-(2-{[2-(azepan-1-yl)ethyl]amino}-2-oxoethyl)-6-methyl-2-oxo-1,2-dihydropyridin-3-yl]-4-methylbenzamide
Compound characteristics
| Compound ID: | P120-0950 |
| Compound Name: | N-[1-(2-{[2-(azepan-1-yl)ethyl]amino}-2-oxoethyl)-6-methyl-2-oxo-1,2-dihydropyridin-3-yl]-4-methylbenzamide |
| Molecular Weight: | 424.54 |
| Molecular Formula: | C24 H32 N4 O3 |
| Smiles: | CC1=CC=C(C(N1CC(NCCN1CCCCCC1)=O)=O)NC(c1ccc(C)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3521 |
| logD: | 0.8665 |
| logSw: | -2.8919 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 68.108 |
| InChI Key: | JVRASTIVOHWIPS-UHFFFAOYSA-N |