N-{[5-({2-[(2,3-dihydro-1,4-benzodioxin-6-yl)amino]-2-oxoethyl}sulfanyl)-1,3,4-oxadiazol-2-yl]methyl}-4-methoxybenzamide
Chemical Structure Depiction of
N-{[5-({2-[(2,3-dihydro-1,4-benzodioxin-6-yl)amino]-2-oxoethyl}sulfanyl)-1,3,4-oxadiazol-2-yl]methyl}-4-methoxybenzamide
N-{[5-({2-[(2,3-dihydro-1,4-benzodioxin-6-yl)amino]-2-oxoethyl}sulfanyl)-1,3,4-oxadiazol-2-yl]methyl}-4-methoxybenzamide
Compound characteristics
| Compound ID: | C328-0032 |
| Compound Name: | N-{[5-({2-[(2,3-dihydro-1,4-benzodioxin-6-yl)amino]-2-oxoethyl}sulfanyl)-1,3,4-oxadiazol-2-yl]methyl}-4-methoxybenzamide |
| Molecular Weight: | 456.48 |
| Molecular Formula: | C21 H20 N4 O6 S |
| Smiles: | COc1ccc(cc1)C(NCc1nnc(o1)SCC(Nc1ccc2c(c1)OCCO2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.1003 |
| logD: | 1.1003 |
| logSw: | -2.3494 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 100.931 |
| InChI Key: | ZGLHPCQGWXCZNV-UHFFFAOYSA-N |