3-(3-{[(5-methyl-1H-benzimidazol-2-yl)sulfanyl]methyl}-1,2,4-oxadiazol-5-yl)-N-(4-methylphenyl)propanamide
Chemical Structure Depiction of
3-(3-{[(5-methyl-1H-benzimidazol-2-yl)sulfanyl]methyl}-1,2,4-oxadiazol-5-yl)-N-(4-methylphenyl)propanamide
3-(3-{[(5-methyl-1H-benzimidazol-2-yl)sulfanyl]methyl}-1,2,4-oxadiazol-5-yl)-N-(4-methylphenyl)propanamide
Compound characteristics
| Compound ID: | J021-0413 |
| Compound Name: | 3-(3-{[(5-methyl-1H-benzimidazol-2-yl)sulfanyl]methyl}-1,2,4-oxadiazol-5-yl)-N-(4-methylphenyl)propanamide |
| Molecular Weight: | 407.49 |
| Molecular Formula: | C21 H21 N5 O2 S |
| Smiles: | Cc1ccc(cc1)NC(CCc1nc(CSc2nc3cc(C)ccc3[nH]2)no1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9683 |
| logD: | 3.9075 |
| logSw: | -3.9882 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 73.463 |
| InChI Key: | MJDLWSPNVWRYHW-UHFFFAOYSA-N |