5-{3-[(2H-1,3-benzodioxol-5-yl)amino]-3-oxopropyl}-N-(4-methylphenyl)-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
5-{3-[(2H-1,3-benzodioxol-5-yl)amino]-3-oxopropyl}-N-(4-methylphenyl)-1,3,4-thiadiazole-2-carboxamide
5-{3-[(2H-1,3-benzodioxol-5-yl)amino]-3-oxopropyl}-N-(4-methylphenyl)-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | G713-0032 |
| Compound Name: | 5-{3-[(2H-1,3-benzodioxol-5-yl)amino]-3-oxopropyl}-N-(4-methylphenyl)-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 410.45 |
| Molecular Formula: | C20 H18 N4 O4 S |
| Smiles: | Cc1ccc(cc1)NC(c1nnc(CCC(Nc2ccc3c(c2)OCO3)=O)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1736 |
| logD: | 3.1736 |
| logSw: | -3.4411 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 87.322 |
| InChI Key: | BPARKQRAOIRICJ-UHFFFAOYSA-N |