6-methyl-5-{4-[3-(thiophen-2-yl)-1H-pyrazole-5-carbonyl]piperazine-1-sulfonyl}pyrimidine-2,4(1H,3H)-dione
Chemical Structure Depiction of
6-methyl-5-{4-[3-(thiophen-2-yl)-1H-pyrazole-5-carbonyl]piperazine-1-sulfonyl}pyrimidine-2,4(1H,3H)-dione
6-methyl-5-{4-[3-(thiophen-2-yl)-1H-pyrazole-5-carbonyl]piperazine-1-sulfonyl}pyrimidine-2,4(1H,3H)-dione
Compound characteristics
| Compound ID: | E687-0075 |
| Compound Name: | 6-methyl-5-{4-[3-(thiophen-2-yl)-1H-pyrazole-5-carbonyl]piperazine-1-sulfonyl}pyrimidine-2,4(1H,3H)-dione |
| Molecular Weight: | 450.49 |
| Molecular Formula: | C17 H18 N6 O5 S2 |
| Smiles: | CC1=C(C(NC(N1)=O)=O)S(N1CCN(CC1)C(c1cc(c2cccs2)n[nH]1)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.2341 |
| logD: | -2.5333 |
| logSw: | -2.4689 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 120.448 |
| InChI Key: | CNCAVTVIXLSUGI-UHFFFAOYSA-N |