2-{[5-(4-butylbenzene-1-sulfonyl)-6-oxo-1,6-dihydropyrimidin-2-yl]sulfanyl}-N-(3-chloro-4-methoxyphenyl)acetamide
Chemical Structure Depiction of
2-{[5-(4-butylbenzene-1-sulfonyl)-6-oxo-1,6-dihydropyrimidin-2-yl]sulfanyl}-N-(3-chloro-4-methoxyphenyl)acetamide
2-{[5-(4-butylbenzene-1-sulfonyl)-6-oxo-1,6-dihydropyrimidin-2-yl]sulfanyl}-N-(3-chloro-4-methoxyphenyl)acetamide
Compound characteristics
| Compound ID: | G605-0638 |
| Compound Name: | 2-{[5-(4-butylbenzene-1-sulfonyl)-6-oxo-1,6-dihydropyrimidin-2-yl]sulfanyl}-N-(3-chloro-4-methoxyphenyl)acetamide |
| Molecular Weight: | 522.04 |
| Molecular Formula: | C23 H24 Cl N3 O5 S2 |
| Smiles: | CCCCc1ccc(cc1)S(C1=CN=C(NC1=O)SCC(Nc1ccc(c(c1)[Cl])OC)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4983 |
| logD: | 2.8566 |
| logSw: | -4.6488 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 94.771 |
| InChI Key: | JHHZZPROYLXHFI-UHFFFAOYSA-N |