N-(3-acetylphenyl)-3-(3-{[(1,3-benzothiazol-2-yl)sulfanyl]methyl}-1,2,4-oxadiazol-5-yl)propanamide
Chemical Structure Depiction of
N-(3-acetylphenyl)-3-(3-{[(1,3-benzothiazol-2-yl)sulfanyl]methyl}-1,2,4-oxadiazol-5-yl)propanamide
N-(3-acetylphenyl)-3-(3-{[(1,3-benzothiazol-2-yl)sulfanyl]methyl}-1,2,4-oxadiazol-5-yl)propanamide
Compound characteristics
Compound ID: | J021-1491 |
Compound Name: | N-(3-acetylphenyl)-3-(3-{[(1,3-benzothiazol-2-yl)sulfanyl]methyl}-1,2,4-oxadiazol-5-yl)propanamide |
Molecular Weight: | 438.53 |
Molecular Formula: | C21 H18 N4 O3 S2 |
Smiles: | CC(c1cccc(c1)NC(CCc1nc(CSc2nc3ccccc3s2)no1)=O)=O |
Stereo: | ACHIRAL |
logP: | 4.1719 |
logD: | 4.1717 |
logSw: | -4.2877 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 78.358 |
InChI Key: | CGOVSNXKGOZQTB-UHFFFAOYSA-N |