2-{4-[5-(3-chlorophenyl)thiophene-2-carbonyl]piperazin-1-yl}-N-[2-(3,4-dimethoxyphenyl)ethyl]pyridine-3-carboxamide
Chemical Structure Depiction of
2-{4-[5-(3-chlorophenyl)thiophene-2-carbonyl]piperazin-1-yl}-N-[2-(3,4-dimethoxyphenyl)ethyl]pyridine-3-carboxamide
2-{4-[5-(3-chlorophenyl)thiophene-2-carbonyl]piperazin-1-yl}-N-[2-(3,4-dimethoxyphenyl)ethyl]pyridine-3-carboxamide
Compound characteristics
| Compound ID: | V006-0684 |
| Compound Name: | 2-{4-[5-(3-chlorophenyl)thiophene-2-carbonyl]piperazin-1-yl}-N-[2-(3,4-dimethoxyphenyl)ethyl]pyridine-3-carboxamide |
| Molecular Weight: | 591.13 |
| Molecular Formula: | C31 H31 Cl N4 O4 S |
| Salt: | not_available |
| Smiles: | [H]C1([H])CN(CC([H])([H])N1C(c1ccc(c2cccc(c2)[Cl])s1)=O)c1c(cccn1)C(NCCc1ccc(c(c1)OC)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 5.4844 |
| logD: | 5.4842 |
| logSw: | -5.896 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.39 |
| InChI Key: | KHZSKEMCGGQPMM-UHFFFAOYSA-N |