2,3-Dihydro-5-iodo-2-thioxo-4(1H)-pyrimidinone
TL;DR: 2,3-Dihydro-5-iodo-2-thioxo-4(1H)-pyrimidinone (CAS 3565-15-9) is a chemical compound with molecular formula C4H3IN2OS and molecular weight 253.90 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-iodo-2-sulfanylidene-1H-pyrimidin-4-one
Also Known As: Iodothiouracil, Iothiouracil, Itrumil, Jodthiouracilum, Iodotiouracilo
| Molecular Formula | C4H3IN2OS |
|---|---|
| Molecular Weight | 253.90 g/mol |
| LogP | 1.03709 |
| Topological Polar Surface Area | 48.65 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 253.90108 |
| Heavy Atoms | 9 |
| Complexity | 314.83395 |
Chemical Identifiers
| CAS Number | 3565-15-9 |
|---|---|
| SMILES | C1=C(C(=O)NC(=S)N1)I |
Product Overview
2,3-Dihydro-5-iodo-2-thioxo-4(1H)-pyrimidinone (CAS 3565-15-9), with molecular formula C4H3IN2OS and molecular weight 253.90 g/mol. IUPAC: 5-iodo-2-sulfanylidene-1H-pyrimidin-4-one.
Chemical Property Profile of 2,3-Dihydro-5-iodo-2-thioxo-4(1H)-pyrimidinone
Property Insights of 2,3-Dihydro-5-iodo-2-thioxo-4(1H)-pyrimidinone
The XLogP value of 1.03709 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,3-Dihydro-5-iodo-2-thioxo-4(1H)-pyrimidinone. With a topological polar surface area (TPSA) of 48.65 Ų, 2,3-Dihydro-5-iodo-2-thioxo-4(1H)-pyrimidinone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,3-Dihydro-5-iodo-2-thioxo-4(1H)-pyrimidinone has 2 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-Dihydro-5-iodo-2-thioxo-4(1H)-pyrimidinone?
The CAS number of 2,3-Dihydro-5-iodo-2-thioxo-4(1H)-pyrimidinone is 3565-15-9.
What is the molecular formula of 2,3-Dihydro-5-iodo-2-thioxo-4(1H)-pyrimidinone?
The molecular formula of 2,3-Dihydro-5-iodo-2-thioxo-4(1H)-pyrimidinone is C4H3IN2OS.
What is the molecular weight of 2,3-Dihydro-5-iodo-2-thioxo-4(1H)-pyrimidinone?
The molecular weight of 2,3-Dihydro-5-iodo-2-thioxo-4(1H)-pyrimidinone is 253.90 g/mol.
Where can I buy 2,3-Dihydro-5-iodo-2-thioxo-4(1H)-pyrimidinone?
You can request a quote for 2,3-Dihydro-5-iodo-2-thioxo-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 2,3-Dihydro-5-iodo-2-thioxo-4(1H)-pyrimidinone?
Yes, KEHONG BIO provides custom synthesis services for 2,3-Dihydro-5-iodo-2-thioxo-4(1H)-pyrimidinone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.