N-{5-[(2-acetamido-2-oxoethyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-2-[(5-methoxy-1H-benzimidazol-2-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-{5-[(2-acetamido-2-oxoethyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-2-[(5-methoxy-1H-benzimidazol-2-yl)sulfanyl]acetamide
N-{5-[(2-acetamido-2-oxoethyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-2-[(5-methoxy-1H-benzimidazol-2-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | Y510-5018 |
| Compound Name: | N-{5-[(2-acetamido-2-oxoethyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-2-[(5-methoxy-1H-benzimidazol-2-yl)sulfanyl]acetamide |
| Molecular Weight: | 452.53 |
| Molecular Formula: | C16 H16 N6 O4 S3 |
| Smiles: | CC(NC(CSc1nnc(NC(CSc2nc3cc(ccc3[nH]2)OC)=O)s1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.281 |
| logD: | 1.2795 |
| logSw: | -2.3091 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 108.806 |
| InChI Key: | GSMHDHPPSSEQHO-UHFFFAOYSA-N |