5-Chloro-6-hydroxy-1,3-dimethyl-5,6-dihydrothymine
TL;DR: 5-Chloro-6-hydroxy-1,3-dimethyl-5,6-dihydrothymine (CAS 100201-55-6) is a chemical compound with molecular formula C7H11ClN2O3 and molecular weight 206.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-chloro-6-hydroxy-1,3,5-trimethyl-1,3-diazinane-2,4-dione
Also Known As: 5-Chloro-6-hydroxy-1,3-dimethyl-5,6-dihydrothymine, 5-chloro-6-hydroxy-1,3,5-trimethyl-1,3-diazinane-2,4-dione, 5-Chloro-6-hydroxy-1,3,5-trimethyldihydro-2,4(1H,3H)-pyrimidinedione #
| Molecular Formula | C7H11ClN2O3 |
|---|---|
| Molecular Weight | 206.05 g/mol |
| LogP | -0.4 |
| Topological Polar Surface Area | 60.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 206.04582 |
| Heavy Atoms | 13 |
| Complexity | 270.0 |
Chemical Identifiers
| CAS Number | 100201-55-6 |
|---|---|
| SMILES | CC1(C(N(C(=O)N(C1=O)C)C)O)Cl |
| InChIKey | QNSKCQKTYHFPNN-UHFFFAOYSA-N |
Product Overview
5-Chloro-6-hydroxy-1,3-dimethyl-5,6-dihydrothymine (CAS 100201-55-6), with molecular formula C7H11ClN2O3 and molecular weight 206.05 g/mol. IUPAC: 5-chloro-6-hydroxy-1,3,5-trimethyl-1,3-diazinane-2,4-dione.
Chemical Property Profile of 5-Chloro-6-hydroxy-1,3-dimethyl-5,6-dihydrothymine
Property Insights of 5-Chloro-6-hydroxy-1,3-dimethyl-5,6-dihydrothymine
The XLogP value of -0.4 indicates that 5-Chloro-6-hydroxy-1,3-dimethyl-5,6-dihydrothymine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 60.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Chloro-6-hydroxy-1,3-dimethyl-5,6-dihydrothymine. Following Lipinski's Rule of Five, 5-Chloro-6-hydroxy-1,3-dimethyl-5,6-dihydrothymine 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 5-Chloro-6-hydroxy-1,3-dimethyl-5,6-dihydrothymine?
The CAS number of 5-Chloro-6-hydroxy-1,3-dimethyl-5,6-dihydrothymine is 100201-55-6.
What is the molecular formula of 5-Chloro-6-hydroxy-1,3-dimethyl-5,6-dihydrothymine?
The molecular formula of 5-Chloro-6-hydroxy-1,3-dimethyl-5,6-dihydrothymine is C7H11ClN2O3.
What is the molecular weight of 5-Chloro-6-hydroxy-1,3-dimethyl-5,6-dihydrothymine?
The molecular weight of 5-Chloro-6-hydroxy-1,3-dimethyl-5,6-dihydrothymine is 206.05 g/mol.
Where can I buy 5-Chloro-6-hydroxy-1,3-dimethyl-5,6-dihydrothymine?
You can request a quote for 5-Chloro-6-hydroxy-1,3-dimethyl-5,6-dihydrothymine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Chloro-6-hydroxy-1,3-dimethyl-5,6-dihydrothymine?
Yes, KEHONG BIO provides custom synthesis services for 5-Chloro-6-hydroxy-1,3-dimethyl-5,6-dihydrothymine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.