N-(3-acetylphenyl)-2-({6-[4-(3-methoxyphenyl)piperazin-1-yl]pyrimidin-4-yl}sulfanyl)acetamide
Chemical Structure Depiction of
N-(3-acetylphenyl)-2-({6-[4-(3-methoxyphenyl)piperazin-1-yl]pyrimidin-4-yl}sulfanyl)acetamide
N-(3-acetylphenyl)-2-({6-[4-(3-methoxyphenyl)piperazin-1-yl]pyrimidin-4-yl}sulfanyl)acetamide
Compound characteristics
| Compound ID: | M179-3086 |
| Compound Name: | N-(3-acetylphenyl)-2-({6-[4-(3-methoxyphenyl)piperazin-1-yl]pyrimidin-4-yl}sulfanyl)acetamide |
| Molecular Weight: | 477.58 |
| Molecular Formula: | C25 H27 N5 O3 S |
| Smiles: | CC(c1cccc(c1)NC(CSc1cc(ncn1)N1CCN(CC1)c1cccc(c1)OC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3225 |
| logD: | 4.3223 |
| logSw: | -4.2968 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.834 |
| InChI Key: | DSHITSJPYCUUPT-UHFFFAOYSA-N |