N-(6-methoxy-1,3-benzothiazol-2-yl)-2-{6-methyl-4-oxo-5-[4-(pyrimidin-2-yl)piperazine-1-sulfonyl]thieno[2,3-d]pyrimidin-3(4H)-yl}acetamide
Chemical Structure Depiction of
N-(6-methoxy-1,3-benzothiazol-2-yl)-2-{6-methyl-4-oxo-5-[4-(pyrimidin-2-yl)piperazine-1-sulfonyl]thieno[2,3-d]pyrimidin-3(4H)-yl}acetamide
N-(6-methoxy-1,3-benzothiazol-2-yl)-2-{6-methyl-4-oxo-5-[4-(pyrimidin-2-yl)piperazine-1-sulfonyl]thieno[2,3-d]pyrimidin-3(4H)-yl}acetamide
Compound characteristics
| Compound ID: | C210-0002 |
| Compound Name: | N-(6-methoxy-1,3-benzothiazol-2-yl)-2-{6-methyl-4-oxo-5-[4-(pyrimidin-2-yl)piperazine-1-sulfonyl]thieno[2,3-d]pyrimidin-3(4H)-yl}acetamide |
| Molecular Weight: | 612.71 |
| Molecular Formula: | C25 H24 N8 O5 S3 |
| Smiles: | Cc1c(c2C(N(CC(Nc3nc4ccc(cc4s3)OC)=O)C=Nc2s1)=O)S(N1CCN(CC1)c1ncccn1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9108 |
| logD: | 2.9108 |
| logSw: | -3.4546 |
| Hydrogen bond acceptors count: | 14 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 120.029 |
| InChI Key: | SJIPZLSMWJAFCY-UHFFFAOYSA-N |