3-benzoyl-5-heptyl-6-hydroxy-2-{[2-(morpholin-4-yl)ethyl]sulfanyl}pyrimidin-4(3H)-one--hydrogen chloride (1/1)
Chemical Structure Depiction of
3-benzoyl-5-heptyl-6-hydroxy-2-{[2-(morpholin-4-yl)ethyl]sulfanyl}pyrimidin-4(3H)-one--hydrogen chloride (1/1)
3-benzoyl-5-heptyl-6-hydroxy-2-{[2-(morpholin-4-yl)ethyl]sulfanyl}pyrimidin-4(3H)-one--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | 3772-2705 |
| Compound Name: | 3-benzoyl-5-heptyl-6-hydroxy-2-{[2-(morpholin-4-yl)ethyl]sulfanyl}pyrimidin-4(3H)-one--hydrogen chloride (1/1) |
| Molecular Weight: | 496.07 |
| Molecular Formula: | C24 H33 N3 O4 S |
| Salt: | HCl |
| Smiles: | CCCCCCCC1=C(N=C(N(C1=O)C(c1ccccc1)=O)SCCN1CCOCC1)O |
| Stereo: | ACHIRAL |
| logP: | 3.6543 |
| logD: | 3.6543 |
| logSw: | -3.5571 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.417 |
| InChI Key: | DIHLNRNECQECRV-UHFFFAOYSA-N |