5-Propynylcytosine
TL;DR: 5-Propynylcytosine (CAS 151091-68-8) is a chemical compound with molecular formula C7H7N3O and molecular weight 149.05891 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
6-amino-5-prop-1-ynyl-1H-pyrimidin-2-one
Also Known As: 5-propynylcytosine, 5-propynyl-cytosine, 5-(1-propynyl)cytosine, 6-Amino-5-(prop-1-yn-1-yl)pyrimidin-2(1H)-one, 6-amino-5-prop-1-ynyl-1H-pyrimidin-2-one
Technical Specifications
| Molecular Formula | C7H7N3O |
| Molecular Weight | 149.05891 g/mol |
| XLogP | -0.4 |
| Topological Polar Surface Area (TPSA) | 67.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 149.05891 Da |
| Heavy Atoms | 11 |
| Complexity | 313.0 |
| SMILES | CC#CC1=C(NC(=O)N=C1)N |
| InChIKey | QNNARSZPGNJZIX-UHFFFAOYSA-N |
Chemical Property Profile of 5-Propynylcytosine
Property Insights of 5-Propynylcytosine
The XLogP value of -0.4 indicates that 5-Propynylcytosine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 67.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Propynylcytosine. Following Lipinski's Rule of Five, 5-Propynylcytosine 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
What is the CAS number of 5-Propynylcytosine?
The CAS number of 5-Propynylcytosine is 151091-68-8.
What is the molecular formula of 5-Propynylcytosine?
The molecular formula of 5-Propynylcytosine is C7H7N3O.
What is the molecular weight of 5-Propynylcytosine?
The molecular weight of 5-Propynylcytosine is 149.05891 g/mol.
Where can I buy 5-Propynylcytosine?
You can request a quote for 5-Propynylcytosine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 5-Propynylcytosine?
Yes, CoreyChem provides custom synthesis services for 5-Propynylcytosine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.