![2-methyl-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one structure](/static/products/1859/18593-67-4.webp)
2-methyl-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one
TL;DR: 2-methyl-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one (CAS 18593-67-4) is a chemical compound with molecular formula C13H10N2OS and molecular weight 242.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methyl-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one
Also Known As: 2-methyl-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one, 2-Methyl-5-phenylthieno[2,3-d]pyrimidin-4(3H)-one, 2-Methyl-5-phenylthieno[2,3-d]pyrimidin-4(1H)-one, 2-methyl-5-phenyl-1H,4H-thieno[2,3-d]pyrimidin-4-one, 2-methyl-5-phenyl-3H,4H-thieno[2,3-d]pyrimidin-4-one
| Molecular Formula | C13H10N2OS |
|---|---|
| Molecular Weight | 242.05 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 69.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 242.05139 |
| Heavy Atoms | 17 |
| Complexity | 349.0 |
Chemical Identifiers
| CAS Number | 18593-67-4 |
|---|---|
| SMILES | CC1=NC2=C(C(=CS2)C3=CC=CC=C3)C(=O)N1 |
| InChIKey | BOXCBFCOYBRNFR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-methyl-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one (CAS 18593-67-4), with molecular formula C13H10N2OS and molecular weight 242.05 g/mol. IUPAC: 2-methyl-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one.
Chemical Property Profile of 2-methyl-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one
Property Insights of 2-methyl-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-methyl-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one. The TPSA of 69.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-methyl-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one. Following Lipinski's Rule of Five, 2-methyl-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one has 1 hydrogen bond donor(s) and 3 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-methyl-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one?
The CAS number of 2-methyl-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one is 18593-67-4.
What is the molecular formula of 2-methyl-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one?
The molecular formula of 2-methyl-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one is C13H10N2OS.
What is the molecular weight of 2-methyl-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one?
The molecular weight of 2-methyl-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one is 242.05 g/mol.
Where can I buy 2-methyl-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one?
You can request a quote for 2-methyl-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-methyl-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one?
Yes, KEHONG BIO provides custom synthesis services for 2-methyl-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.