3-(benzenesulfonyl)-N-{5-[2-(4-methoxyphenyl)ethyl]-1,3,4-thiadiazol-2-yl}propanamide
Chemical Structure Depiction of
3-(benzenesulfonyl)-N-{5-[2-(4-methoxyphenyl)ethyl]-1,3,4-thiadiazol-2-yl}propanamide
3-(benzenesulfonyl)-N-{5-[2-(4-methoxyphenyl)ethyl]-1,3,4-thiadiazol-2-yl}propanamide
Compound characteristics
| Compound ID: | Y031-3510 |
| Compound Name: | 3-(benzenesulfonyl)-N-{5-[2-(4-methoxyphenyl)ethyl]-1,3,4-thiadiazol-2-yl}propanamide |
| Molecular Weight: | 431.53 |
| Molecular Formula: | C20 H21 N3 O4 S2 |
| Smiles: | COc1ccc(CCc2nnc(NC(CCS(c3ccccc3)(=O)=O)=O)s2)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.2006 |
| logD: | 2.8618 |
| logSw: | -3.6601 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83.465 |
| InChI Key: | TZBMBIQGPNKDGS-UHFFFAOYSA-N |