2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]-1-[4-(6-nitro-1,3-benzothiazol-2-yl)piperazin-1-yl]ethan-1-one
Chemical Structure Depiction of
2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]-1-[4-(6-nitro-1,3-benzothiazol-2-yl)piperazin-1-yl]ethan-1-one
2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]-1-[4-(6-nitro-1,3-benzothiazol-2-yl)piperazin-1-yl]ethan-1-one
Compound characteristics
| Compound ID: | 8010-2723 |
| Compound Name: | 2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]-1-[4-(6-nitro-1,3-benzothiazol-2-yl)piperazin-1-yl]ethan-1-one |
| Molecular Weight: | 436.53 |
| Molecular Formula: | C16 H16 N6 O3 S3 |
| Smiles: | Cc1nnc(SCC(N2CCN(CC2)c2nc3ccc(cc3s2)[N+]([O-])=O)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 2.7548 |
| logD: | 2.7548 |
| logSw: | -3.0196 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 85.208 |
| InChI Key: | DMQSLYBEIBBNTN-UHFFFAOYSA-N |