3-chloro-N-(2-methylbutyl)-N-(2-{4-[(4-methylphenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)benzamide
Chemical Structure Depiction of
3-chloro-N-(2-methylbutyl)-N-(2-{4-[(4-methylphenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)benzamide
3-chloro-N-(2-methylbutyl)-N-(2-{4-[(4-methylphenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)benzamide
Compound characteristics
| Compound ID: | V024-7380 |
| Compound Name: | 3-chloro-N-(2-methylbutyl)-N-(2-{4-[(4-methylphenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)benzamide |
| Molecular Weight: | 525.11 |
| Molecular Formula: | C29 H33 Cl N2 O3 S |
| Smiles: | CCC(C)CN(CC(N1CCc2c(ccs2)C1COc1ccc(C)cc1)=O)C(c1cccc(c1)[Cl])=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 6.7598 |
| logD: | 6.7598 |
| logSw: | -6.3249 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 40.286 |
| InChI Key: | KPGZQQKYHRNVSQ-UHFFFAOYSA-N |