4-chloro-N-(2-{4-[(4-fluorophenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)-N-[2-(pyrrolidin-1-yl)ethyl]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-[2-(pyrrolidin-1-yl)ethyl]benzene-1-sulfonamide
4-chloro-N-(2-{4-[(4-fluorophenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)-N-[2-(pyrrolidin-1-yl)ethyl]benzene-1-sulfonamide
Compound characteristics
| Compound ID: | V021-1866 |
| Compound Name: | 4-chloro-N-(2-{4-[(4-fluorophenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)-N-[2-(pyrrolidin-1-yl)ethyl]benzene-1-sulfonamide |
| Molecular Weight: | 592.15 |
| Molecular Formula: | C28 H31 Cl F N3 O4 S2 |
| Salt: | not_available |
| Smiles: | C1CCN(C1)CCN(CC(N1CCc2c(ccs2)C1COc1ccc(cc1)F)=O)S(c1ccc(cc1)[Cl])(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.1238 |
| logD: | 4.2357 |
| logSw: | -5.5744 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 59.506 |
| InChI Key: | YGXNPVCMODFBPA-SANMLTNESA-N |