![7-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-3-hydroxy-4-iminopyrrolo[2,3-d]pyrimidine-5-carbonitrile structure](/static/products/6121/61210-35-3.webp)
7-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-3-hydroxy-4-iminopyrrolo[2,3-d]pyrimidine-5-carbonitrile
TL;DR: 7-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-3-hydroxy-4-iminopyrrolo[2,3-d]pyrimidine-5-carbonitrile (CAS 61210-35-3) is a chemical compound with molecular formula C12H13N5O5 and molecular weight 307.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-3-hydroxy-4-iminopyrrolo[2,3-d]pyrimidine-5-carbonitrile
Also Known As: 7-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-3-hydroxy-4-iminopyrrolo[2,3-d]pyrimidine-5-carbonitrile, 3-Hydroxy-4-imino-7-pentofuranosyl-4,7-dihydro-3H-pyrrolo[2,3-d]pyrimidine-5-carbonitrile
| Molecular Formula | C12H13N5O5 |
|---|---|
| Molecular Weight | 307.09 g/mol |
| LogP | -1.96225 |
| Topological Polar Surface Area | 160.54 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 2 |
| Exact Mass | 307.09167 |
| Heavy Atoms | 22 |
| Complexity | 821.6469 |
Chemical Identifiers
| CAS Number | 61210-35-3 |
|---|---|
| SMILES | C1=C(C2=C(N1C3C(C(C(O3)CO)O)O)N=CN(C2=N)O)C#N |
Product Overview
7-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-3-hydroxy-4-iminopyrrolo[2,3-d]pyrimidine-5-carbonitrile (CAS 61210-35-3), with molecular formula C12H13N5O5 and molecular weight 307.09 g/mol. IUPAC: 7-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-3-hydroxy-4-iminopyrrolo[2,3-d]pyrimidine-5-carbonitrile.
Chemical Property Profile of 7-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-3-hydroxy-4-iminopyrrolo[2,3-d]pyrimidine-5-carbonitrile
Property Insights of 7-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-3-hydroxy-4-iminopyrrolo[2,3-d]pyrimidine-5-carbonitrile
The XLogP value of -1.96225 indicates that 7-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-3-hydroxy-4-iminopyrrolo[2,3-d]pyrimidine-5-carbonitrile is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 160.54 Ų indicates high polarity, suggesting 7-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-3-hydroxy-4-iminopyrrolo[2,3-d]pyrimidine-5-carbonitrile may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 7-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-3-hydroxy-4-iminopyrrolo[2,3-d]pyrimidine-5-carbonitrile has 5 hydrogen bond donor(s) and 8 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 7-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-3-hydroxy-4-iminopyrrolo[2,3-d]pyrimidine-5-carbonitrile?
The CAS number of 7-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-3-hydroxy-4-iminopyrrolo[2,3-d]pyrimidine-5-carbonitrile is 61210-35-3.
What is the molecular formula of 7-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-3-hydroxy-4-iminopyrrolo[2,3-d]pyrimidine-5-carbonitrile?
The molecular formula of 7-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-3-hydroxy-4-iminopyrrolo[2,3-d]pyrimidine-5-carbonitrile is C12H13N5O5.
What is the molecular weight of 7-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-3-hydroxy-4-iminopyrrolo[2,3-d]pyrimidine-5-carbonitrile?
The molecular weight of 7-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-3-hydroxy-4-iminopyrrolo[2,3-d]pyrimidine-5-carbonitrile is 307.09 g/mol.
Where can I buy 7-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-3-hydroxy-4-iminopyrrolo[2,3-d]pyrimidine-5-carbonitrile?
You can request a quote for 7-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-3-hydroxy-4-iminopyrrolo[2,3-d]pyrimidine-5-carbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-3-hydroxy-4-iminopyrrolo[2,3-d]pyrimidine-5-carbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 7-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-3-hydroxy-4-iminopyrrolo[2,3-d]pyrimidine-5-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.