3-chloro-N-(2-{4-[(3-methoxyphenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)-N-(prop-2-en-1-yl)benzamide
Chemical Structure Depiction of
3-chloro-N-(2-{4-[(3-methoxyphenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)-N-(prop-2-en-1-yl)benzamide
3-chloro-N-(2-{4-[(3-methoxyphenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)-N-(prop-2-en-1-yl)benzamide
Compound characteristics
| Compound ID: | V002-2641 |
| Compound Name: | 3-chloro-N-(2-{4-[(3-methoxyphenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)-N-(prop-2-en-1-yl)benzamide |
| Molecular Weight: | 511.04 |
| Molecular Formula: | C27 H27 Cl N2 O4 S |
| Smiles: | COc1cccc(c1)OCC1c2ccsc2CCN1C(CN(CC=C)C(c1cccc(c1)[Cl])=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.1328 |
| logD: | 5.1328 |
| logSw: | -5.5941 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 47.808 |
| InChI Key: | RSTAWPZPDWYLLE-DEOSSOPVSA-N |