![3-(4-Chlorophenyl)-7-methyl-5H-pyrimido[2,1-b][1,3]thiazol-5-one structure](/static/products/2342/23429-91-6.webp)
3-(4-Chlorophenyl)-7-methyl-5H-pyrimido[2,1-b][1,3]thiazol-5-one
TL;DR: 3-(4-Chlorophenyl)-7-methyl-5H-pyrimido[2,1-b][1,3]thiazol-5-one (CAS 23429-91-6) is a chemical compound with molecular formula C13H9ClN2OS and molecular weight 276.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4-chlorophenyl)-7-methyl-[1,3]thiazolo[3,2-a]pyrimidin-5-one
Also Known As: Maybridge1_006120, RDR 00973, 3-(4-Chlorophenyl)-7-methyl-5H-pyrimido[2,1-b][1,3]thiazol-5-one, 3-(4-chlorophenyl)-7-methyl-[1,3]thiazolo[3,2-a]pyrimidin-5-one, 3-(4-chlorophenyl)-7-methyl-[1,3]thiazolo[3,2-a]pyrimidin-5-
| Molecular Formula | C13H9ClN2OS |
|---|---|
| Molecular Weight | 276.01 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 58.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 276.01242 |
| Heavy Atoms | 18 |
| Complexity | 475.0 |
Chemical Identifiers
| CAS Number | 23429-91-6 |
|---|---|
| SMILES | CC1=CC(=O)N2C(=CSC2=N1)C3=CC=C(C=C3)Cl |
| InChIKey | PHDCQCLUKJDFOY-UHFFFAOYSA-N |
Product Overview
3-(4-Chlorophenyl)-7-methyl-5H-pyrimido[2,1-b][1,3]thiazol-5-one (CAS 23429-91-6), with molecular formula C13H9ClN2OS and molecular weight 276.01 g/mol. IUPAC: 3-(4-chlorophenyl)-7-methyl-[1,3]thiazolo[3,2-a]pyrimidin-5-one.
Chemical Property Profile of 3-(4-Chlorophenyl)-7-methyl-5H-pyrimido[2,1-b][1,3]thiazol-5-one
Property Insights of 3-(4-Chlorophenyl)-7-methyl-5H-pyrimido[2,1-b][1,3]thiazol-5-one
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(4-Chlorophenyl)-7-methyl-5H-pyrimido[2,1-b][1,3]thiazol-5-one. With a topological polar surface area (TPSA) of 58.0 Ų, 3-(4-Chlorophenyl)-7-methyl-5H-pyrimido[2,1-b][1,3]thiazol-5-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(4-Chlorophenyl)-7-methyl-5H-pyrimido[2,1-b][1,3]thiazol-5-one has 0 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 3-(4-Chlorophenyl)-7-methyl-5H-pyrimido[2,1-b][1,3]thiazol-5-one?
The CAS number of 3-(4-Chlorophenyl)-7-methyl-5H-pyrimido[2,1-b][1,3]thiazol-5-one is 23429-91-6.
What is the molecular formula of 3-(4-Chlorophenyl)-7-methyl-5H-pyrimido[2,1-b][1,3]thiazol-5-one?
The molecular formula of 3-(4-Chlorophenyl)-7-methyl-5H-pyrimido[2,1-b][1,3]thiazol-5-one is C13H9ClN2OS.
What is the molecular weight of 3-(4-Chlorophenyl)-7-methyl-5H-pyrimido[2,1-b][1,3]thiazol-5-one?
The molecular weight of 3-(4-Chlorophenyl)-7-methyl-5H-pyrimido[2,1-b][1,3]thiazol-5-one is 276.01 g/mol.
Where can I buy 3-(4-Chlorophenyl)-7-methyl-5H-pyrimido[2,1-b][1,3]thiazol-5-one?
You can request a quote for 3-(4-Chlorophenyl)-7-methyl-5H-pyrimido[2,1-b][1,3]thiazol-5-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(4-Chlorophenyl)-7-methyl-5H-pyrimido[2,1-b][1,3]thiazol-5-one?
Yes, KEHONG BIO provides custom synthesis services for 3-(4-Chlorophenyl)-7-methyl-5H-pyrimido[2,1-b][1,3]thiazol-5-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.