N-tert-butyl-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-tert-butyl-N-(2-{4-[(4-chloro-3-methylphenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)-2-methylbenzamide
N-tert-butyl-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: | V023-8947 |
| Compound Name: | N-tert-butyl-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: | Cc1ccccc1C(N(CC(N1CCc2c(ccs2)C1COc1ccc(c(C)c1)[Cl])=O)C(C)(C)C)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.7727 |
| logD: | 6.7727 |
| logSw: | -6.287 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 40.393 |
| InChI Key: | UJUAWFGERNGBSW-VWLOTQADSA-N |