N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-{[3-(methylsulfanyl)-1,2,4-thiadiazol-5-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-{[3-(methylsulfanyl)-1,2,4-thiadiazol-5-yl]sulfanyl}acetamide
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-{[3-(methylsulfanyl)-1,2,4-thiadiazol-5-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | D139-0342 |
| Compound Name: | N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-{[3-(methylsulfanyl)-1,2,4-thiadiazol-5-yl]sulfanyl}acetamide |
| Molecular Weight: | 355.45 |
| Molecular Formula: | C13 H13 N3 O3 S3 |
| Smiles: | CSc1nc(SCC(Nc2ccc3c(c2)OCCO3)=O)sn1 |
| Stereo: | ACHIRAL |
| logP: | 2.3998 |
| logD: | 2.3998 |
| logSw: | -2.986 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.841 |
| InChI Key: | ZMWVRCPXBGXCSJ-UHFFFAOYSA-N |