N-(3-methylphenyl)-2-({6-oxo-5-[4-(propan-2-yl)benzene-1-sulfonyl]-1,6-dihydropyrimidin-2-yl}sulfanyl)acetamide
Chemical Structure Depiction of
N-(3-methylphenyl)-2-({6-oxo-5-[4-(propan-2-yl)benzene-1-sulfonyl]-1,6-dihydropyrimidin-2-yl}sulfanyl)acetamide
N-(3-methylphenyl)-2-({6-oxo-5-[4-(propan-2-yl)benzene-1-sulfonyl]-1,6-dihydropyrimidin-2-yl}sulfanyl)acetamide
Compound characteristics
Compound ID: | C716-0356 |
Compound Name: | N-(3-methylphenyl)-2-({6-oxo-5-[4-(propan-2-yl)benzene-1-sulfonyl]-1,6-dihydropyrimidin-2-yl}sulfanyl)acetamide |
Molecular Weight: | 457.57 |
Molecular Formula: | C22 H23 N3 O4 S2 |
Smiles: | CC(C)c1ccc(cc1)S(C1=CN=C(NC1=O)SCC(Nc1cccc(C)c1)=O)(=O)=O |
Stereo: | ACHIRAL |
logP: | 3.7166 |
logD: | 2.0749 |
logSw: | -3.8065 |
Hydrogen bond acceptors count: | 10 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 87.14 |
InChI Key: | OXCXLURQXVPJFG-UHFFFAOYSA-N |