2-{[2-(dimethylamino)ethyl]sulfanyl}-6-hydroxy-5-pentylpyrimidin-4(3H)-one--hydrogen chloride (1/3)
Chemical Structure Depiction of
2-{[2-(dimethylamino)ethyl]sulfanyl}-6-hydroxy-5-pentylpyrimidin-4(3H)-one--hydrogen chloride (1/3)
2-{[2-(dimethylamino)ethyl]sulfanyl}-6-hydroxy-5-pentylpyrimidin-4(3H)-one--hydrogen chloride (1/3)
Compound characteristics
| Compound ID: | 5267-1075 |
| Compound Name: | 2-{[2-(dimethylamino)ethyl]sulfanyl}-6-hydroxy-5-pentylpyrimidin-4(3H)-one--hydrogen chloride (1/3) |
| Molecular Weight: | 394.79 |
| Molecular Formula: | C13 H23 N3 O2 S |
| Salt: | 3HCl |
| Smiles: | CCCCCC1=C(N=C(NC1=O)SCCN(C)C)O |
| Stereo: | ACHIRAL |
| logP: | 2.1021 |
| logD: | 2.1021 |
| logSw: | -2.3352 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 54.809 |
| InChI Key: | RQGAPHQJIHYAOZ-UHFFFAOYSA-N |