ddToy
TL;DR: ddToy (CAS 115044-81-0) is a chemical compound with molecular formula C12H13N5O2 and molecular weight 259.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-amino-7-[(2R,5S)-5-(hydroxymethyl)oxolan-2-yl]pyrrolo[2,3-d]pyrimidine-5-carbonitrile
Also Known As: ddToy, Dideoxytoyocamycin, 7-Cyano-7-deaza-2',3'-dideoxyadenosine, 7H-Pyrrolo(2,3-d)pyrimidine-5-carbonitrile, 4-amino-7-((2R,5S)-tetrahydro-5-(hydroxymethyl)-2-furanyl)-, 7H-Pyrrolo(2,3-d)pyrimidine-5-carbonitrile, 4-amino-7-(tetrahydro-5-(hydroxymethyl)-2-furanyl)-, (2R-cis)-0
| Molecular Formula | C12H13N5O2 |
|---|---|
| Molecular Weight | 259.11 g/mol |
| LogP | -0.2 |
| Topological Polar Surface Area | 110.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 259.10693 |
| Heavy Atoms | 19 |
| Complexity | 384.0 |
Chemical Identifiers
| CAS Number | 115044-81-0 |
|---|---|
| SMILES | C1C[C@@H](O[C@@H]1CO)N2C=C(C3=C(N=CN=C32)N)C#N |
| InChIKey | ZQWLOVYPSSKGMA-DTWKUNHWSA-N |
Product Overview
ddToy (CAS 115044-81-0), with molecular formula C12H13N5O2 and molecular weight 259.11 g/mol. IUPAC: 4-amino-7-[(2R,5S)-5-(hydroxymethyl)oxolan-2-yl]pyrrolo[2,3-d]pyrimidine-5-carbonitrile.
Chemical Property Profile of ddToy
Property Insights of ddToy
The XLogP value of -0.2 indicates that ddToy is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 110.0 Ų falls within the moderate polarity range, balancing permeability and solubility for ddToy. Following Lipinski's Rule of Five, ddToy has 2 hydrogen bond donor(s) and 6 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 ddToy?
The CAS number of ddToy is 115044-81-0.
What is the molecular formula of ddToy?
The molecular formula of ddToy is C12H13N5O2.
What is the molecular weight of ddToy?
The molecular weight of ddToy is 259.11 g/mol.
Where can I buy ddToy?
You can request a quote for ddToy directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ddToy?
Yes, KEHONG BIO provides custom synthesis services for ddToy and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.