2-{[4-amino-5-(5-chlorothiophene-2-sulfonyl)pyrimidin-2-yl]sulfanyl}-N-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide
Chemical Structure Depiction of
2-{[4-amino-5-(5-chlorothiophene-2-sulfonyl)pyrimidin-2-yl]sulfanyl}-N-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide
2-{[4-amino-5-(5-chlorothiophene-2-sulfonyl)pyrimidin-2-yl]sulfanyl}-N-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide
Compound characteristics
| Compound ID: | F409-0185 |
| Compound Name: | 2-{[4-amino-5-(5-chlorothiophene-2-sulfonyl)pyrimidin-2-yl]sulfanyl}-N-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide |
| Molecular Weight: | 498.98 |
| Molecular Formula: | C18 H15 Cl N4 O5 S3 |
| Smiles: | C1COc2cc(ccc2O1)NC(CSc1ncc(c(N)n1)S(c1ccc(s1)[Cl])(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0043 |
| logD: | 2.0043 |
| logSw: | -2.9741 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 107.97 |
| InChI Key: | GBAJCUXDEBHVDG-UHFFFAOYSA-N |