1-(5-Phenyl-5,6-dihydropyrimidin-1(4H)-yl)ethan-1-one--hydrogen chloride (1/1)
TL;DR: 1-(5-Phenyl-5,6-dihydropyrimidin-1(4H)-yl)ethan-1-one--hydrogen chloride (1/1) (CAS 114703-63-8) is a chemical compound with molecular formula C12H15ClN2O and molecular weight 238.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(5-phenyl-5,6-dihydro-4H-pyrimidin-1-yl)ethanone;hydrochloride
Also Known As: 1-Acetyl-5-phenyl-1,4,5,6-tetrahydropyrimidine hydrochloride, 1,4,5,6-Tetrahydro-1-acetyl-5-phenylpyrimidine monohydrochloride, Pyrimidine, 1,4,5,6-tetrahydro-1-acetyl-5-phenyl-, monohydrochloride, 1-(5-phenyl-5,6-dihydro-4H-pyrimidin-1-yl)ethanone hydrochloride, 1-(5-phenyl-5,6-dihydro-4H-pyrimidin-1-yl)ethanone,hydrochloride
| Molecular Formula | C12H15ClN2O |
|---|---|
| Molecular Weight | 238.09 g/mol |
| LogP | 2.0824 |
| Topological Polar Surface Area | 32.67 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 238.0873 |
| Heavy Atoms | 16 |
| Complexity | 377.86496 |
Chemical Identifiers
| CAS Number | 114703-63-8 |
|---|---|
| SMILES | CC(=O)N1CC(CN=C1)C2=CC=CC=C2.Cl |
Product Overview
1-(5-Phenyl-5,6-dihydropyrimidin-1(4H)-yl)ethan-1-one--hydrogen chloride (1/1) (CAS 114703-63-8), with molecular formula C12H15ClN2O and molecular weight 238.09 g/mol. IUPAC: 1-(5-phenyl-5,6-dihydro-4H-pyrimidin-1-yl)ethanone;hydrochloride.
Chemical Property Profile of 1-(5-Phenyl-5,6-dihydropyrimidin-1(4H)-yl)ethan-1-one--hydrogen chloride (1/1)
Property Insights of 1-(5-Phenyl-5,6-dihydropyrimidin-1(4H)-yl)ethan-1-one--hydrogen chloride (1/1)
The XLogP value of 2.0824 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(5-Phenyl-5,6-dihydropyrimidin-1(4H)-yl)ethan-1-one--hydrogen chloride (1/1). With a topological polar surface area (TPSA) of 32.67 Ų, 1-(5-Phenyl-5,6-dihydropyrimidin-1(4H)-yl)ethan-1-one--hydrogen chloride (1/1) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(5-Phenyl-5,6-dihydropyrimidin-1(4H)-yl)ethan-1-one--hydrogen chloride (1/1) has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-(5-Phenyl-5,6-dihydropyrimidin-1(4H)-yl)ethan-1-one--hydrogen chloride (1/1)?
The CAS number of 1-(5-Phenyl-5,6-dihydropyrimidin-1(4H)-yl)ethan-1-one--hydrogen chloride (1/1) is 114703-63-8.
What is the molecular formula of 1-(5-Phenyl-5,6-dihydropyrimidin-1(4H)-yl)ethan-1-one--hydrogen chloride (1/1)?
The molecular formula of 1-(5-Phenyl-5,6-dihydropyrimidin-1(4H)-yl)ethan-1-one--hydrogen chloride (1/1) is C12H15ClN2O.
What is the molecular weight of 1-(5-Phenyl-5,6-dihydropyrimidin-1(4H)-yl)ethan-1-one--hydrogen chloride (1/1)?
The molecular weight of 1-(5-Phenyl-5,6-dihydropyrimidin-1(4H)-yl)ethan-1-one--hydrogen chloride (1/1) is 238.09 g/mol.
Where can I buy 1-(5-Phenyl-5,6-dihydropyrimidin-1(4H)-yl)ethan-1-one--hydrogen chloride (1/1)?
You can request a quote for 1-(5-Phenyl-5,6-dihydropyrimidin-1(4H)-yl)ethan-1-one--hydrogen chloride (1/1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(5-Phenyl-5,6-dihydropyrimidin-1(4H)-yl)ethan-1-one--hydrogen chloride (1/1)?
Yes, KEHONG BIO provides custom synthesis services for 1-(5-Phenyl-5,6-dihydropyrimidin-1(4H)-yl)ethan-1-one--hydrogen chloride (1/1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.