N-{4-[4-(azepane-1-carbonyl)quinolin-2-yl]phenyl}propanamide
Chemical Structure Depiction of
N-{4-[4-(azepane-1-carbonyl)quinolin-2-yl]phenyl}propanamide
N-{4-[4-(azepane-1-carbonyl)quinolin-2-yl]phenyl}propanamide
Compound characteristics
| Compound ID: | L036-0041 |
| Compound Name: | N-{4-[4-(azepane-1-carbonyl)quinolin-2-yl]phenyl}propanamide |
| Molecular Weight: | 401.51 |
| Molecular Formula: | C25 H27 N3 O2 |
| Smiles: | [H]c1ccc2c(c1)c(cc(c1ccc(cc1)NC(CC)=O)n2)C(N1CCCCCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9864 |
| logD: | 4.9863 |
| logSw: | -4.7515 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.426 |
| InChI Key: | LMZWRWBUWXNPTL-UHFFFAOYSA-N |