2,5,6-trimethyl-3H,4H-thieno(2,3-d)pyrimidin-4-one
TL;DR: 2,5,6-trimethyl-3H,4H-thieno(2,3-d)pyrimidin-4-one (CAS 18593-45-8) is a chemical compound with molecular formula C9H10N2OS and molecular weight 194.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,5,6-trimethyl-3H-thieno[2,3-d]pyrimidin-4-one
Also Known As: 2,5,6-trimethyl-3H,4H-thieno[2,3-d]pyrimidin-4-one, 2,5,6-Trimethylthieno[2,3-d]pyrimidin-4(3H)-one, 2,5,6-Trimethyl-3H-thieno[2,3-d]pyrimidin-4-one, BAS 05438577, J2.715.588J
| Molecular Formula | C9H10N2OS |
|---|---|
| Molecular Weight | 194.05 g/mol |
| LogP | 1.90986 |
| Topological Polar Surface Area | 45.75 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 194.05139 |
| Heavy Atoms | 13 |
| Complexity | 524.1296 |
Chemical Identifiers
| CAS Number | 18593-45-8 |
|---|---|
| SMILES | CC1=C(SC2=C1C(=O)NC(=N2)C)C |
Product Overview
2,5,6-trimethyl-3H,4H-thieno(2,3-d)pyrimidin-4-one (CAS 18593-45-8), with molecular formula C9H10N2OS and molecular weight 194.05 g/mol. IUPAC: 2,5,6-trimethyl-3H-thieno[2,3-d]pyrimidin-4-one.
Chemical Property Profile of 2,5,6-trimethyl-3H,4H-thieno(2,3-d)pyrimidin-4-one
Property Insights of 2,5,6-trimethyl-3H,4H-thieno(2,3-d)pyrimidin-4-one
The XLogP value of 1.90986 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,5,6-trimethyl-3H,4H-thieno(2,3-d)pyrimidin-4-one. With a topological polar surface area (TPSA) of 45.75 Ų, 2,5,6-trimethyl-3H,4H-thieno(2,3-d)pyrimidin-4-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,5,6-trimethyl-3H,4H-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 2,5,6-trimethyl-3H,4H-thieno(2,3-d)pyrimidin-4-one?
The CAS number of 2,5,6-trimethyl-3H,4H-thieno(2,3-d)pyrimidin-4-one is 18593-45-8.
What is the molecular formula of 2,5,6-trimethyl-3H,4H-thieno(2,3-d)pyrimidin-4-one?
The molecular formula of 2,5,6-trimethyl-3H,4H-thieno(2,3-d)pyrimidin-4-one is C9H10N2OS.
What is the molecular weight of 2,5,6-trimethyl-3H,4H-thieno(2,3-d)pyrimidin-4-one?
The molecular weight of 2,5,6-trimethyl-3H,4H-thieno(2,3-d)pyrimidin-4-one is 194.05 g/mol.
Where can I buy 2,5,6-trimethyl-3H,4H-thieno(2,3-d)pyrimidin-4-one?
You can request a quote for 2,5,6-trimethyl-3H,4H-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 2,5,6-trimethyl-3H,4H-thieno(2,3-d)pyrimidin-4-one?
Yes, KEHONG BIO provides custom synthesis services for 2,5,6-trimethyl-3H,4H-thieno(2,3-d)pyrimidin-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.