3-[({4-[4-(2-chlorophenyl)piperazin-1-yl]-6-phenylpyrimidin-2-yl}sulfanyl)methyl]-N-(2-methoxyethyl)benzamide
Chemical Structure Depiction of
3-[({4-[4-(2-chlorophenyl)piperazin-1-yl]-6-phenylpyrimidin-2-yl}sulfanyl)methyl]-N-(2-methoxyethyl)benzamide
3-[({4-[4-(2-chlorophenyl)piperazin-1-yl]-6-phenylpyrimidin-2-yl}sulfanyl)methyl]-N-(2-methoxyethyl)benzamide
Compound characteristics
| Compound ID: | V025-2064 |
| Compound Name: | 3-[({4-[4-(2-chlorophenyl)piperazin-1-yl]-6-phenylpyrimidin-2-yl}sulfanyl)methyl]-N-(2-methoxyethyl)benzamide |
| Molecular Weight: | 574.14 |
| Molecular Formula: | C31 H32 Cl N5 O2 S |
| Salt: | not_available |
| Smiles: | COCCNC(c1cccc(CSc2nc(cc(n2)N2CCN(CC2)c2ccccc2[Cl])c2ccccc2)c1)=O |
| Stereo: | ACHIRAL |
| logP: | 6.8744 |
| logD: | 6.8742 |
| logSw: | -6.2924 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.733 |
| InChI Key: | YYTAVSFDJIZIHT-UHFFFAOYSA-N |