5-Pyrimidinol, 1,4,5,6-tetrahydro-5-phenyl-, monohydrochloride
TL;DR: 5-Pyrimidinol, 1,4,5,6-tetrahydro-5-phenyl-, monohydrochloride (CAS 114703-77-4) is a chemical compound with molecular formula C10H13ClN2O and molecular weight 212.07164 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-phenyl-4,6-dihydro-1H-pyrimidin-5-ol;hydrochloride
Also Known As: CRL 41382, 5-Hydroxy-5-phenyl-1,4,5,6-tetrahydropyrimidine hydrochloride, 2-(4-Chlorophenyl)propane-1,3-diamine, 5-Pyrimidinol, 1,4,5,6-tetrahydro-5-phenyl-, monohydrochloride, 1,4,5,6-Tetrahydro-5-phenyl-5-pyrimidinol monohydrochloride
Technical Specifications
| Molecular Formula | C10H13ClN2O |
| Molecular Weight | 212.07164 g/mol |
| XLogP | 0.9275 |
| Topological Polar Surface Area (TPSA) | 44.6 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 212.07164 Da |
| Heavy Atoms | 14 |
| Complexity | 199.0 |
| SMILES | C1C(CN=CN1)(C2=CC=CC=C2)O.Cl |
| InChIKey | KUOGHDAQWPVQJH-UHFFFAOYSA-N |
Chemical Property Profile of 5-Pyrimidinol, 1,4,5,6-tetrahydro-5-phenyl-, monohydrochloride
Property Insights of 5-Pyrimidinol, 1,4,5,6-tetrahydro-5-phenyl-, monohydrochloride
The XLogP value of 0.9275 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Pyrimidinol, 1,4,5,6-tetrahydro-5-phenyl-, monohydrochloride. With a topological polar surface area (TPSA) of 44.6 Ų, 5-Pyrimidinol, 1,4,5,6-tetrahydro-5-phenyl-, monohydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Pyrimidinol, 1,4,5,6-tetrahydro-5-phenyl-, monohydrochloride has 3 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 5-Pyrimidinol, 1,4,5,6-tetrahydro-5-phenyl-, monohydrochloride?
The CAS number of 5-Pyrimidinol, 1,4,5,6-tetrahydro-5-phenyl-, monohydrochloride is 114703-77-4.
What is the molecular formula of 5-Pyrimidinol, 1,4,5,6-tetrahydro-5-phenyl-, monohydrochloride?
The molecular formula of 5-Pyrimidinol, 1,4,5,6-tetrahydro-5-phenyl-, monohydrochloride is C10H13ClN2O.
What is the molecular weight of 5-Pyrimidinol, 1,4,5,6-tetrahydro-5-phenyl-, monohydrochloride?
The molecular weight of 5-Pyrimidinol, 1,4,5,6-tetrahydro-5-phenyl-, monohydrochloride is 212.07164 g/mol.
Where can I buy 5-Pyrimidinol, 1,4,5,6-tetrahydro-5-phenyl-, monohydrochloride?
You can request a quote for 5-Pyrimidinol, 1,4,5,6-tetrahydro-5-phenyl-, monohydrochloride directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 5-Pyrimidinol, 1,4,5,6-tetrahydro-5-phenyl-, monohydrochloride?
Yes, CoreyChem provides custom synthesis services for 5-Pyrimidinol, 1,4,5,6-tetrahydro-5-phenyl-, monohydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.