N-(2-{4-[(4-chloro-3-methylphenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)-N-[(furan-2-yl)methyl]-2-phenylacetamide
Chemical Structure Depiction of
N-(2-{4-[(4-chloro-3-methylphenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)-N-[(furan-2-yl)methyl]-2-phenylacetamide
N-(2-{4-[(4-chloro-3-methylphenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)-N-[(furan-2-yl)methyl]-2-phenylacetamide
Compound characteristics
| Compound ID: | V023-0096 |
| Compound Name: | N-(2-{4-[(4-chloro-3-methylphenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)-N-[(furan-2-yl)methyl]-2-phenylacetamide |
| Molecular Weight: | 549.09 |
| Molecular Formula: | C30 H29 Cl N2 O4 S |
| Smiles: | Cc1cc(ccc1[Cl])OCC1c2ccsc2CCN1C(CN(Cc1ccco1)C(Cc1ccccc1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.4546 |
| logD: | 6.4546 |
| logSw: | -6.1484 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 47.236 |
| InChI Key: | ZINKCJVEZVSRBD-MHZLTWQESA-N |