4-chloro-N-(cyclopropylmethyl)-N-(2-{4-[(3-methoxyphenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)benzene-1-sulfonamide
Chemical Structure Depiction of
4-chloro-N-(cyclopropylmethyl)-N-(2-{4-[(3-methoxyphenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)benzene-1-sulfonamide
4-chloro-N-(cyclopropylmethyl)-N-(2-{4-[(3-methoxyphenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)benzene-1-sulfonamide
Compound characteristics
| Compound ID: | V012-3690 |
| Compound Name: | 4-chloro-N-(cyclopropylmethyl)-N-(2-{4-[(3-methoxyphenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)benzene-1-sulfonamide |
| Molecular Weight: | 561.12 |
| Molecular Formula: | C27 H29 Cl N2 O5 S2 |
| Smiles: | COc1cccc(c1)OCC1c2ccsc2CCN1C(CN(CC1CC1)S(c1ccc(cc1)[Cl])(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.7298 |
| logD: | 5.7298 |
| logSw: | -5.9474 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 63.246 |
| InChI Key: | BOBIHXJNLPCGAX-VWLOTQADSA-N |