6-{[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]methyl}-2-(4-ethylpiperazin-1-yl)pyrimidin-4(3H)-one
Chemical Structure Depiction of
6-{[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]methyl}-2-(4-ethylpiperazin-1-yl)pyrimidin-4(3H)-one
6-{[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]methyl}-2-(4-ethylpiperazin-1-yl)pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | Y020-2395 |
| Compound Name: | 6-{[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]methyl}-2-(4-ethylpiperazin-1-yl)pyrimidin-4(3H)-one |
| Molecular Weight: | 353.47 |
| Molecular Formula: | C13 H19 N7 O S2 |
| Smiles: | CCN1CCN(CC1)C1NC(C=C(CSc2nnc(N)s2)N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 0.3222 |
| logD: | -1.0435 |
| logSw: | -2.0231 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 85.291 |
| InChI Key: | NUKKECNRJBKWPY-UHFFFAOYSA-N |