methyl 3-[2-({3-[4-(2,3-dimethylphenyl)piperazin-1-yl]pyrazin-2-yl}sulfanyl)acetamido]thiophene-2-carboxylate
Chemical Structure Depiction of
methyl 3-[2-({3-[4-(2,3-dimethylphenyl)piperazin-1-yl]pyrazin-2-yl}sulfanyl)acetamido]thiophene-2-carboxylate
methyl 3-[2-({3-[4-(2,3-dimethylphenyl)piperazin-1-yl]pyrazin-2-yl}sulfanyl)acetamido]thiophene-2-carboxylate
Compound characteristics
| Compound ID: | L981-0622 |
| Compound Name: | methyl 3-[2-({3-[4-(2,3-dimethylphenyl)piperazin-1-yl]pyrazin-2-yl}sulfanyl)acetamido]thiophene-2-carboxylate |
| Molecular Weight: | 497.64 |
| Molecular Formula: | C24 H27 N5 O3 S2 |
| Smiles: | Cc1cccc(c1C)N1CCN(CC1)c1c(nccn1)SCC(Nc1ccsc1C(=O)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5191 |
| logD: | 4.4844 |
| logSw: | -4.1935 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.183 |
| InChI Key: | MJYAZVLCCDIFSM-UHFFFAOYSA-N |