2-{[4-amino-5-(4-methylbenzene-1-sulfonyl)pyrimidin-2-yl]sulfanyl}-N-(4-methylphenyl)acetamide
Chemical Structure Depiction of
2-{[4-amino-5-(4-methylbenzene-1-sulfonyl)pyrimidin-2-yl]sulfanyl}-N-(4-methylphenyl)acetamide
2-{[4-amino-5-(4-methylbenzene-1-sulfonyl)pyrimidin-2-yl]sulfanyl}-N-(4-methylphenyl)acetamide
Compound characteristics
Compound ID: | E682-0155 |
Compound Name: | 2-{[4-amino-5-(4-methylbenzene-1-sulfonyl)pyrimidin-2-yl]sulfanyl}-N-(4-methylphenyl)acetamide |
Molecular Weight: | 428.53 |
Molecular Formula: | C20 H20 N4 O3 S2 |
Smiles: | Cc1ccc(cc1)NC(CSc1ncc(c(N)n1)S(c1ccc(C)cc1)(=O)=O)=O |
Stereo: | ACHIRAL |
logP: | 3.5498 |
logD: | 3.5498 |
logSw: | -3.7394 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 3 |
Polar surface area: | 91.129 |
InChI Key: | NZSQIQJABXGSOP-UHFFFAOYSA-N |