2-{[4-amino-5-(thiophene-2-sulfonyl)pyrimidin-2-yl]sulfanyl}-N-(4H-1,2,4-triazol-3-yl)acetamide
Chemical Structure Depiction of
2-{[4-amino-5-(thiophene-2-sulfonyl)pyrimidin-2-yl]sulfanyl}-N-(4H-1,2,4-triazol-3-yl)acetamide
2-{[4-amino-5-(thiophene-2-sulfonyl)pyrimidin-2-yl]sulfanyl}-N-(4H-1,2,4-triazol-3-yl)acetamide
Compound characteristics
| Compound ID: | M191-0004 |
| Compound Name: | 2-{[4-amino-5-(thiophene-2-sulfonyl)pyrimidin-2-yl]sulfanyl}-N-(4H-1,2,4-triazol-3-yl)acetamide |
| Molecular Weight: | 397.45 |
| Molecular Formula: | C12 H11 N7 O3 S3 |
| Smiles: | C(C(Nc1nnc[nH]1)=O)Sc1ncc(c(N)n1)S(c1cccs1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | -0.6305 |
| logD: | -0.645 |
| logSw: | -2.0882 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 128.984 |
| InChI Key: | GRXPTEMMUQRTAR-UHFFFAOYSA-N |