N-(butan-2-yl)-N-(2-{4-[(4-chloro-3-methylphenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)-2-methylbenzamide
Chemical Structure Depiction of
N-(butan-2-yl)-N-(2-{4-[(4-chloro-3-methylphenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)-2-methylbenzamide
N-(butan-2-yl)-N-(2-{4-[(4-chloro-3-methylphenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)-2-methylbenzamide
Compound characteristics
| Compound ID: | V022-1819 |
| Compound Name: | N-(butan-2-yl)-N-(2-{4-[(4-chloro-3-methylphenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)-2-methylbenzamide |
| Molecular Weight: | 525.11 |
| Molecular Formula: | C29 H33 Cl N2 O3 S |
| Smiles: | CCC(C)N(CC(N1CCc2c(ccs2)C1COc1ccc(c(C)c1)[Cl])=O)C(c1ccccc1C)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 7.0274 |
| logD: | 7.0274 |
| logSw: | -6.3651 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 39.614 |
| InChI Key: | YFZPQNBTOMDMJH-UHFFFAOYSA-N |