N-(5-chloro-2,4-dimethoxyphenyl)-2-{[4-(4-phenylpiperazin-1-yl)pyrimidin-2-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-(5-chloro-2,4-dimethoxyphenyl)-2-{[4-(4-phenylpiperazin-1-yl)pyrimidin-2-yl]sulfanyl}acetamide
N-(5-chloro-2,4-dimethoxyphenyl)-2-{[4-(4-phenylpiperazin-1-yl)pyrimidin-2-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | M459-0924 |
| Compound Name: | N-(5-chloro-2,4-dimethoxyphenyl)-2-{[4-(4-phenylpiperazin-1-yl)pyrimidin-2-yl]sulfanyl}acetamide |
| Molecular Weight: | 500.02 |
| Molecular Formula: | C24 H26 Cl N5 O3 S |
| Smiles: | COc1cc(c(cc1NC(CSc1nccc(n1)N1CCN(CC1)c1ccccc1)=O)[Cl])OC |
| Stereo: | ACHIRAL |
| logP: | 4.7533 |
| logD: | 4.7461 |
| logSw: | -4.9468 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.581 |
| InChI Key: | KXYKCJVWVWMYJY-UHFFFAOYSA-N |