3-(3-{[(5-chloro-1H-benzimidazol-2-yl)sulfanyl]methyl}-1,2,4-oxadiazol-5-yl)-N-(2-methyl-1,3-dioxo-2,3-dihydro-1H-isoindol-5-yl)propanamide
Chemical Structure Depiction of
3-(3-{[(5-chloro-1H-benzimidazol-2-yl)sulfanyl]methyl}-1,2,4-oxadiazol-5-yl)-N-(2-methyl-1,3-dioxo-2,3-dihydro-1H-isoindol-5-yl)propanamide
3-(3-{[(5-chloro-1H-benzimidazol-2-yl)sulfanyl]methyl}-1,2,4-oxadiazol-5-yl)-N-(2-methyl-1,3-dioxo-2,3-dihydro-1H-isoindol-5-yl)propanamide
Compound characteristics
| Compound ID: | J021-3314 |
| Compound Name: | 3-(3-{[(5-chloro-1H-benzimidazol-2-yl)sulfanyl]methyl}-1,2,4-oxadiazol-5-yl)-N-(2-methyl-1,3-dioxo-2,3-dihydro-1H-isoindol-5-yl)propanamide |
| Molecular Weight: | 496.93 |
| Molecular Formula: | C22 H17 Cl N6 O4 S |
| Smiles: | CN1C(c2ccc(cc2C1=O)NC(CCc1nc(CSc2nc3cc(ccc3[nH]2)[Cl])no1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2872 |
| logD: | 3.1894 |
| logSw: | -3.8086 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 102.753 |
| InChI Key: | DMTHAAXCPLZMJM-UHFFFAOYSA-N |