N-[5-(ethylsulfanyl)-1,3,4-thiadiazol-2-yl]-2-({4-methyl-5-[(1-methyl-1H-pyrrol-2-yl)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
Chemical Structure Depiction of
N-[5-(ethylsulfanyl)-1,3,4-thiadiazol-2-yl]-2-({4-methyl-5-[(1-methyl-1H-pyrrol-2-yl)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
N-[5-(ethylsulfanyl)-1,3,4-thiadiazol-2-yl]-2-({4-methyl-5-[(1-methyl-1H-pyrrol-2-yl)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
Compound characteristics
| Compound ID: | C592-3963 |
| Compound Name: | N-[5-(ethylsulfanyl)-1,3,4-thiadiazol-2-yl]-2-({4-methyl-5-[(1-methyl-1H-pyrrol-2-yl)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide |
| Molecular Weight: | 409.55 |
| Molecular Formula: | C15 H19 N7 O S3 |
| Smiles: | CCSc1nnc(NC(CSc2nnc(Cc3cccn3C)n2C)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 2.6059 |
| logD: | 2.6037 |
| logSw: | -2.9257 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.98 |
| InChI Key: | OEFIDHUOQPIKLV-UHFFFAOYSA-N |