1'-{[(4-{[(4-chlorophenyl)sulfanyl]methyl}-6-oxo-1,6-dihydropyrimidin-2-yl)sulfanyl]acetyl}[1,4'-bipiperidine]-4'-carboxamide
Chemical Structure Depiction of
1'-{[(4-{[(4-chlorophenyl)sulfanyl]methyl}-6-oxo-1,6-dihydropyrimidin-2-yl)sulfanyl]acetyl}[1,4'-bipiperidine]-4'-carboxamide
1'-{[(4-{[(4-chlorophenyl)sulfanyl]methyl}-6-oxo-1,6-dihydropyrimidin-2-yl)sulfanyl]acetyl}[1,4'-bipiperidine]-4'-carboxamide
Compound characteristics
| Compound ID: | 8015-7544 |
| Compound Name: | 1'-{[(4-{[(4-chlorophenyl)sulfanyl]methyl}-6-oxo-1,6-dihydropyrimidin-2-yl)sulfanyl]acetyl}[1,4'-bipiperidine]-4'-carboxamide |
| Molecular Weight: | 536.11 |
| Molecular Formula: | C24 H30 Cl N5 O3 S2 |
| Smiles: | C1CCN(CC1)C1(CCN(CC1)C(CSC1NC(C=C(CSc2ccc(cc2)[Cl])N=1)=O)=O)C(N)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7574 |
| logD: | 2.7574 |
| logSw: | -3.5127 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 88.163 |
| InChI Key: | HYPZJVXDINNOFM-UHFFFAOYSA-N |