N-(2-{4-[(4-chloro-3-methylphenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)-3-methyl-N-(prop-2-en-1-yl)benzamide
Chemical Structure Depiction of
N-(2-{4-[(4-chloro-3-methylphenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)-3-methyl-N-(prop-2-en-1-yl)benzamide
N-(2-{4-[(4-chloro-3-methylphenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)-3-methyl-N-(prop-2-en-1-yl)benzamide
Compound characteristics
| Compound ID: | V022-6808 |
| Compound Name: | N-(2-{4-[(4-chloro-3-methylphenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)-3-methyl-N-(prop-2-en-1-yl)benzamide |
| Molecular Weight: | 509.07 |
| Molecular Formula: | C28 H29 Cl N2 O3 S |
| Smiles: | Cc1cccc(c1)C(N(CC=C)CC(N1CCc2c(ccs2)C1COc1ccc(c(C)c1)[Cl])=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.0729 |
| logD: | 6.0729 |
| logSw: | -6.1874 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 40.265 |
| InChI Key: | FDHGJIDAZQQKCR-VWLOTQADSA-N |