2-[(7-amino-7H-[1,2,4]triazolo[4,3-b][1,2,4]triazol-3-yl)sulfanyl]-N-[5-(butylsulfanyl)-1,3,4-thiadiazol-2-yl]acetamide
Chemical Structure Depiction of
2-[(7-amino-7H-[1,2,4]triazolo[4,3-b][1,2,4]triazol-3-yl)sulfanyl]-N-[5-(butylsulfanyl)-1,3,4-thiadiazol-2-yl]acetamide
2-[(7-amino-7H-[1,2,4]triazolo[4,3-b][1,2,4]triazol-3-yl)sulfanyl]-N-[5-(butylsulfanyl)-1,3,4-thiadiazol-2-yl]acetamide
Compound characteristics
| Compound ID: | 8008-7039 |
| Compound Name: | 2-[(7-amino-7H-[1,2,4]triazolo[4,3-b][1,2,4]triazol-3-yl)sulfanyl]-N-[5-(butylsulfanyl)-1,3,4-thiadiazol-2-yl]acetamide |
| Molecular Weight: | 385.49 |
| Molecular Formula: | C11 H15 N9 O S3 |
| Smiles: | CCCCSc1nnc(NC(CSc2nnc3n(cnn23)N)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 1.3579 |
| logD: | 1.3557 |
| logSw: | -1.9467 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 100.598 |
| InChI Key: | DKPBXCJBWCPQDQ-UHFFFAOYSA-N |