2,3,6-trimethyl-5-phenylpyrimidin-4(3H)-one
TL;DR: 2,3,6-trimethyl-5-phenylpyrimidin-4(3H)-one (CAS 202820-41-5) is a chemical compound with molecular formula C13H14N2O and molecular weight 214.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,3,6-trimethyl-5-phenylpyrimidin-4-one
Also Known As: ChemDiv2_000505, MixCom6_000987, DivK1c_005419, CDS1_004379, 2,3,6-trimethyl-5-phenylpyrimidin-4-one
| Molecular Formula | C13H14N2O |
|---|---|
| Molecular Weight | 214.11 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 32.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 214.11061 |
| Heavy Atoms | 16 |
| Complexity | 362.0 |
Chemical Identifiers
| CAS Number | 202820-41-5 |
|---|---|
| SMILES | CC1=C(C(=O)N(C(=N1)C)C)C2=CC=CC=C2 |
| InChIKey | OMEQABFSMVKBOX-UHFFFAOYSA-N |
Product Overview
2,3,6-trimethyl-5-phenylpyrimidin-4(3H)-one (CAS 202820-41-5), with molecular formula C13H14N2O and molecular weight 214.11 g/mol. IUPAC: 2,3,6-trimethyl-5-phenylpyrimidin-4-one.
Chemical Property Profile of 2,3,6-trimethyl-5-phenylpyrimidin-4(3H)-one
Property Insights of 2,3,6-trimethyl-5-phenylpyrimidin-4(3H)-one
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,3,6-trimethyl-5-phenylpyrimidin-4(3H)-one. With a topological polar surface area (TPSA) of 32.7 Ų, 2,3,6-trimethyl-5-phenylpyrimidin-4(3H)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,3,6-trimethyl-5-phenylpyrimidin-4(3H)-one 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 2,3,6-trimethyl-5-phenylpyrimidin-4(3H)-one?
The CAS number of 2,3,6-trimethyl-5-phenylpyrimidin-4(3H)-one is 202820-41-5.
What is the molecular formula of 2,3,6-trimethyl-5-phenylpyrimidin-4(3H)-one?
The molecular formula of 2,3,6-trimethyl-5-phenylpyrimidin-4(3H)-one is C13H14N2O.
What is the molecular weight of 2,3,6-trimethyl-5-phenylpyrimidin-4(3H)-one?
The molecular weight of 2,3,6-trimethyl-5-phenylpyrimidin-4(3H)-one is 214.11 g/mol.
Where can I buy 2,3,6-trimethyl-5-phenylpyrimidin-4(3H)-one?
You can request a quote for 2,3,6-trimethyl-5-phenylpyrimidin-4(3H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,3,6-trimethyl-5-phenylpyrimidin-4(3H)-one?
Yes, KEHONG BIO provides custom synthesis services for 2,3,6-trimethyl-5-phenylpyrimidin-4(3H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.