2-{4-[5-(3,4-difluorophenyl)thiophene-2-carbonyl]piperazin-1-yl}-N-[(4-methoxyphenyl)methyl]pyridine-3-carboxamide
Chemical Structure Depiction of
2-{4-[5-(3,4-difluorophenyl)thiophene-2-carbonyl]piperazin-1-yl}-N-[(4-methoxyphenyl)methyl]pyridine-3-carboxamide
2-{4-[5-(3,4-difluorophenyl)thiophene-2-carbonyl]piperazin-1-yl}-N-[(4-methoxyphenyl)methyl]pyridine-3-carboxamide
Compound characteristics
| Compound ID: | V006-0696 |
| Compound Name: | 2-{4-[5-(3,4-difluorophenyl)thiophene-2-carbonyl]piperazin-1-yl}-N-[(4-methoxyphenyl)methyl]pyridine-3-carboxamide |
| Molecular Weight: | 548.61 |
| Molecular Formula: | C29 H26 F2 N4 O3 S |
| Salt: | not_available |
| Smiles: | [H]C1([H])CN(CC([H])([H])N1C(c1ccc(c2ccc(c(c2)F)F)s1)=O)c1c(cccn1)C(NCc1ccc(cc1)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 5.7298 |
| logD: | 5.7294 |
| logSw: | -5.3951 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.832 |
| InChI Key: | KFAMICANJFWPSI-UHFFFAOYSA-N |