2-{[4-amino-5-(5-bromothiophene-2-sulfonyl)pyrimidin-2-yl]sulfanyl}-N-(4-cyanophenyl)acetamide
Chemical Structure Depiction of
2-{[4-amino-5-(5-bromothiophene-2-sulfonyl)pyrimidin-2-yl]sulfanyl}-N-(4-cyanophenyl)acetamide
2-{[4-amino-5-(5-bromothiophene-2-sulfonyl)pyrimidin-2-yl]sulfanyl}-N-(4-cyanophenyl)acetamide
Compound characteristics
| Compound ID: | F409-0260 |
| Compound Name: | 2-{[4-amino-5-(5-bromothiophene-2-sulfonyl)pyrimidin-2-yl]sulfanyl}-N-(4-cyanophenyl)acetamide |
| Molecular Weight: | 510.41 |
| Molecular Formula: | C17 H12 Br N5 O3 S3 |
| Smiles: | C(C(Nc1ccc(C#N)cc1)=O)Sc1ncc(c(N)n1)S(c1ccc(s1)[Br])(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8331 |
| logD: | 2.8328 |
| logSw: | -3.4889 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 109.203 |
| InChI Key: | KOCBJUROSFMHQK-UHFFFAOYSA-N |