4-chloro-N-(2-{4-[(4-fluorophenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)-N-(prop-2-en-1-yl)benzene-1-sulfonamide
Chemical Structure Depiction of
4-chloro-N-(2-{4-[(4-fluorophenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)-N-(prop-2-en-1-yl)benzene-1-sulfonamide
4-chloro-N-(2-{4-[(4-fluorophenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)-N-(prop-2-en-1-yl)benzene-1-sulfonamide
Compound characteristics
| Compound ID: | V021-9942 |
| Compound Name: | 4-chloro-N-(2-{4-[(4-fluorophenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)-N-(prop-2-en-1-yl)benzene-1-sulfonamide |
| Molecular Weight: | 535.06 |
| Molecular Formula: | C25 H24 Cl F N2 O4 S2 |
| Smiles: | C=CCN(CC(N1CCc2c(ccs2)C1COc1ccc(cc1)F)=O)S(c1ccc(cc1)[Cl])(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.3865 |
| logD: | 5.3865 |
| logSw: | -5.9831 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 55.429 |
| InChI Key: | XOXNCCLEKLXMLO-QHCPKHFHSA-N |