1-{[(4-{[(4-chlorophenyl)sulfanyl]methyl}-6-hydroxypyrimidin-2-yl)sulfanyl]acetyl}piperidine-4-carboxamide
Chemical Structure Depiction of
1-{[(4-{[(4-chlorophenyl)sulfanyl]methyl}-6-hydroxypyrimidin-2-yl)sulfanyl]acetyl}piperidine-4-carboxamide
1-{[(4-{[(4-chlorophenyl)sulfanyl]methyl}-6-hydroxypyrimidin-2-yl)sulfanyl]acetyl}piperidine-4-carboxamide
Compound characteristics
| Compound ID: | Y020-1347 |
| Compound Name: | 1-{[(4-{[(4-chlorophenyl)sulfanyl]methyl}-6-hydroxypyrimidin-2-yl)sulfanyl]acetyl}piperidine-4-carboxamide |
| Molecular Weight: | 452.98 |
| Molecular Formula: | C19 H21 Cl N4 O3 S2 |
| Smiles: | C1CN(CCC1C(N)=O)C(CSc1nc(CSc2ccc(cc2)[Cl])cc(n1)O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4889 |
| logD: | 2.1856 |
| logSw: | -2.8643 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 85.194 |
| InChI Key: | UVYKFYJCLIYDMN-UHFFFAOYSA-N |