ethyl 4-[2-({4-amino-5-[4-(propan-2-yl)benzene-1-sulfonyl]pyrimidin-2-yl}sulfanyl)acetamido]benzoate
Chemical Structure Depiction of
ethyl 4-[2-({4-amino-5-[4-(propan-2-yl)benzene-1-sulfonyl]pyrimidin-2-yl}sulfanyl)acetamido]benzoate
ethyl 4-[2-({4-amino-5-[4-(propan-2-yl)benzene-1-sulfonyl]pyrimidin-2-yl}sulfanyl)acetamido]benzoate
Compound characteristics
| Compound ID: | C200-2872 |
| Compound Name: | ethyl 4-[2-({4-amino-5-[4-(propan-2-yl)benzene-1-sulfonyl]pyrimidin-2-yl}sulfanyl)acetamido]benzoate |
| Molecular Weight: | 514.62 |
| Molecular Formula: | C24 H26 N4 O5 S2 |
| Smiles: | CCOC(c1ccc(cc1)NC(CSc1ncc(c(N)n1)S(c1ccc(cc1)C(C)C)(=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6426 |
| logD: | 4.6425 |
| logSw: | -4.3679 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 111.882 |
| InChI Key: | YSPYAIMHXYQDJE-UHFFFAOYSA-N |