N-[2-(azepan-1-yl)-2-(thiophen-2-yl)ethyl]-3-chloro-4-methoxybenzamide--hydrogen chloride (1/1)
Chemical Structure Depiction of
N-[2-(azepan-1-yl)-2-(thiophen-2-yl)ethyl]-3-chloro-4-methoxybenzamide--hydrogen chloride (1/1)
N-[2-(azepan-1-yl)-2-(thiophen-2-yl)ethyl]-3-chloro-4-methoxybenzamide--hydrogen chloride (1/1)
Compound characteristics
Compound ID: | D388-0728 |
Compound Name: | N-[2-(azepan-1-yl)-2-(thiophen-2-yl)ethyl]-3-chloro-4-methoxybenzamide--hydrogen chloride (1/1) |
Molecular Weight: | 429.41 |
Molecular Formula: | C20 H25 Cl N2 O2 S |
Salt: | HCl |
Smiles: | [H]N(CC(c1cccs1)N1CCCCCC1)C(c1ccc(c(c1)[Cl])OC)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 3.8629 |
logD: | 3.7146 |
logSw: | -4.4205 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 36.621 |
InChI Key: | YQIBLVPGXGFOMB-KRWDZBQOSA-N |