6-Amino-1-(4-chlorophenyl)-2-thioxo-2,3-dihydro-4(1H)-pyrimidinone
TL;DR: 6-Amino-1-(4-chlorophenyl)-2-thioxo-2,3-dihydro-4(1H)-pyrimidinone (CAS 1690-48-8) is a chemical compound with molecular formula C10H8ClN3OS and molecular weight 253.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-amino-1-(4-chlorophenyl)-2-sulfanylidenepyrimidin-4-one
Also Known As: NCIOpen2_004636, 6-Amino-1-(4-chlorophenyl)-2-thioxo-2,3-dihydro-4(1H)-pyrimidinone, 6-amino-1-(4-chlorophenyl)-2-thioxo-2,3-dihydropyrimidin-4(1H)-one, 6-amino-1-(4-chlorophenyl)-2-sulfanylidenepyrimidin-4-one, AR-434/42595452
| Molecular Formula | C10H8ClN3OS |
|---|---|
| Molecular Weight | 253.01 g/mol |
| LogP | 2.13069 |
| Topological Polar Surface Area | 63.81 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 253.00766 |
| Heavy Atoms | 16 |
| Complexity | 629.7478 |
Chemical Identifiers
| CAS Number | 1690-48-8 |
|---|---|
| SMILES | C1=CC(=CC=C1N2C(=CC(=O)NC2=S)N)Cl |
Product Overview
6-Amino-1-(4-chlorophenyl)-2-thioxo-2,3-dihydro-4(1H)-pyrimidinone (CAS 1690-48-8), with molecular formula C10H8ClN3OS and molecular weight 253.01 g/mol. IUPAC: 6-amino-1-(4-chlorophenyl)-2-sulfanylidenepyrimidin-4-one.
Chemical Property Profile of 6-Amino-1-(4-chlorophenyl)-2-thioxo-2,3-dihydro-4(1H)-pyrimidinone
Property Insights of 6-Amino-1-(4-chlorophenyl)-2-thioxo-2,3-dihydro-4(1H)-pyrimidinone
The XLogP value of 2.13069 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-Amino-1-(4-chlorophenyl)-2-thioxo-2,3-dihydro-4(1H)-pyrimidinone. The TPSA of 63.81 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-Amino-1-(4-chlorophenyl)-2-thioxo-2,3-dihydro-4(1H)-pyrimidinone. Following Lipinski's Rule of Five, 6-Amino-1-(4-chlorophenyl)-2-thioxo-2,3-dihydro-4(1H)-pyrimidinone has 2 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 6-Amino-1-(4-chlorophenyl)-2-thioxo-2,3-dihydro-4(1H)-pyrimidinone?
The CAS number of 6-Amino-1-(4-chlorophenyl)-2-thioxo-2,3-dihydro-4(1H)-pyrimidinone is 1690-48-8.
What is the molecular formula of 6-Amino-1-(4-chlorophenyl)-2-thioxo-2,3-dihydro-4(1H)-pyrimidinone?
The molecular formula of 6-Amino-1-(4-chlorophenyl)-2-thioxo-2,3-dihydro-4(1H)-pyrimidinone is C10H8ClN3OS.
What is the molecular weight of 6-Amino-1-(4-chlorophenyl)-2-thioxo-2,3-dihydro-4(1H)-pyrimidinone?
The molecular weight of 6-Amino-1-(4-chlorophenyl)-2-thioxo-2,3-dihydro-4(1H)-pyrimidinone is 253.01 g/mol.
Where can I buy 6-Amino-1-(4-chlorophenyl)-2-thioxo-2,3-dihydro-4(1H)-pyrimidinone?
You can request a quote for 6-Amino-1-(4-chlorophenyl)-2-thioxo-2,3-dihydro-4(1H)-pyrimidinone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Amino-1-(4-chlorophenyl)-2-thioxo-2,3-dihydro-4(1H)-pyrimidinone?
Yes, KEHONG BIO provides custom synthesis services for 6-Amino-1-(4-chlorophenyl)-2-thioxo-2,3-dihydro-4(1H)-pyrimidinone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.