6-methyl-5-{4-[2-(pyridin-4-yl)ethyl]piperazine-1-sulfonyl}pyrimidine-2,4(1H,3H)-dione--hydrogen chloride (1/1)
Chemical Structure Depiction of
6-methyl-5-{4-[2-(pyridin-4-yl)ethyl]piperazine-1-sulfonyl}pyrimidine-2,4(1H,3H)-dione--hydrogen chloride (1/1)
6-methyl-5-{4-[2-(pyridin-4-yl)ethyl]piperazine-1-sulfonyl}pyrimidine-2,4(1H,3H)-dione--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | 8018-4579 |
| Compound Name: | 6-methyl-5-{4-[2-(pyridin-4-yl)ethyl]piperazine-1-sulfonyl}pyrimidine-2,4(1H,3H)-dione--hydrogen chloride (1/1) |
| Molecular Weight: | 415.9 |
| Molecular Formula: | C16 H21 N5 O4 S |
| Salt: | HCl |
| Smiles: | CC1=C(C(NC(N1)=O)=O)S(N1CCN(CCc2ccncc2)CC1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | -0.9795 |
| logD: | -3.7468 |
| logSw: | -1.8129 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 93.431 |
| InChI Key: | GZQMBCFXQCFHKI-UHFFFAOYSA-N |