N-(2-{4-[(3-fluorophenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)-N-(3-methoxypropyl)-4-methylbenzene-1-sulfonamide
Chemical Structure Depiction of
N-(2-{4-[(3-fluorophenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)-N-(3-methoxypropyl)-4-methylbenzene-1-sulfonamide
N-(2-{4-[(3-fluorophenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)-N-(3-methoxypropyl)-4-methylbenzene-1-sulfonamide
Compound characteristics
| Compound ID: | V002-3107 |
| Compound Name: | N-(2-{4-[(3-fluorophenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)-N-(3-methoxypropyl)-4-methylbenzene-1-sulfonamide |
| Molecular Weight: | 546.68 |
| Molecular Formula: | C27 H31 F N2 O5 S2 |
| Smiles: | Cc1ccc(cc1)S(N(CCCOC)CC(N1CCc2c(ccs2)C1COc1cccc(c1)F)=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.9357 |
| logD: | 4.9357 |
| logSw: | -4.6238 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 63.771 |
| InChI Key: | PSHVZLVSLDRHJO-VWLOTQADSA-N |