Compound 229
TL;DR: Compound 229 (CAS 120387-28-2) is a chemical compound with molecular formula C10H13N5O2S and molecular weight 267.079 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-amino-7-(2-hydroxyethoxymethyl)pyrrolo[2,3-d]pyrimidine-5-carbothioamide
Also Known As: Compound 229, 4-amino-7-(2-hydroxyethoxymethyl)pyrrolo[2,3-d]pyrimidine-5-carbothioamide, [1,2]oxazolo[4,3-g][2,1]benzoxazole, 1-Azatricyclo[3.3.1.02,7]nonane(9CI), 4-Amino-7-((2-hydroxyethoxy)methyl)-7H-pyrrolo(2,3-d)pyrimidine-5-carbothioamide
Technical Specifications
| Molecular Formula | C10H13N5O2S |
| Molecular Weight | 267.079 g/mol |
| XLogP | -1.1 |
| Topological Polar Surface Area (TPSA) | 144.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 267.079 Da |
| Heavy Atoms | 18 |
| Complexity | 306.0 |
| SMILES | C1=C(C2=C(N=CN=C2N1COCCO)N)C(=S)N |
| InChIKey | GVCLNACSYKYUHP-UHFFFAOYSA-N |
Chemical Property Profile of Compound 229
Property Insights of Compound 229
The XLogP value of -1.1 indicates that Compound 229 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 144.0 Ų indicates high polarity, suggesting Compound 229 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Compound 229 has 3 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Compound 229?
The CAS number of Compound 229 is 120387-28-2.
What is the molecular formula of Compound 229?
The molecular formula of Compound 229 is C10H13N5O2S.
What is the molecular weight of Compound 229?
The molecular weight of Compound 229 is 267.079 g/mol.
Where can I buy Compound 229?
You can request a quote for Compound 229 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Compound 229?
Yes, CoreyChem provides custom synthesis services for Compound 229 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.