2-[4-(4-methoxyphenyl)piperazin-1-yl]-6-{[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]methyl}pyrimidin-4(3H)-one
Chemical Structure Depiction of
2-[4-(4-methoxyphenyl)piperazin-1-yl]-6-{[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]methyl}pyrimidin-4(3H)-one
2-[4-(4-methoxyphenyl)piperazin-1-yl]-6-{[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]methyl}pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | Y020-7554 |
| Compound Name: | 2-[4-(4-methoxyphenyl)piperazin-1-yl]-6-{[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]methyl}pyrimidin-4(3H)-one |
| Molecular Weight: | 476.56 |
| Molecular Formula: | C23 H24 N8 O2 S |
| Smiles: | COc1ccc(cc1)N1CCN(CC1)C1NC(C=C(CSc2nnnn2c2ccccc2)N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0768 |
| logD: | 3.048 |
| logSw: | -3.4726 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 88.817 |
| InChI Key: | SIBZDGMCKIYBCR-UHFFFAOYSA-N |