N-[3-(azepan-1-yl)propyl]-4-{[2,3-dioxo-4-(prop-2-en-1-yl)-3,4-dihydroquinoxalin-1(2H)-yl]methyl}benzamide
Chemical Structure Depiction of
N-[3-(azepan-1-yl)propyl]-4-{[2,3-dioxo-4-(prop-2-en-1-yl)-3,4-dihydroquinoxalin-1(2H)-yl]methyl}benzamide
N-[3-(azepan-1-yl)propyl]-4-{[2,3-dioxo-4-(prop-2-en-1-yl)-3,4-dihydroquinoxalin-1(2H)-yl]methyl}benzamide
Compound characteristics
| Compound ID: | L059-0581 |
| Compound Name: | N-[3-(azepan-1-yl)propyl]-4-{[2,3-dioxo-4-(prop-2-en-1-yl)-3,4-dihydroquinoxalin-1(2H)-yl]methyl}benzamide |
| Molecular Weight: | 474.6 |
| Molecular Formula: | C28 H34 N4 O3 |
| Smiles: | C=CCN1C(C(N(Cc2ccc(cc2)C(NCCCN2CCCCCC2)=O)c2ccccc12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3712 |
| logD: | 0.8005 |
| logSw: | -3.5269 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.342 |
| InChI Key: | LNAKVLAXVZCLLY-UHFFFAOYSA-N |