![2-(4-Aminopyrrolo[2,3-d]pyrimidin-7-yl)-5-(butylsulfanylmethyl)oxolane-3,4-diol structure](/static/products/5345/53458-39-2.webp)
2-(4-Aminopyrrolo[2,3-d]pyrimidin-7-yl)-5-(butylsulfanylmethyl)oxolane-3,4-diol
TL;DR: 2-(4-Aminopyrrolo[2,3-d]pyrimidin-7-yl)-5-(butylsulfanylmethyl)oxolane-3,4-diol (CAS 53458-39-2) is a chemical compound with molecular formula C15H22N4O3S and molecular weight 338.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-aminopyrrolo[2,3-d]pyrimidin-7-yl)-5-(butylsulfanylmethyl)oxolane-3,4-diol
Also Known As: 2-(4-aminopyrrolo[2,3-d]pyrimidin-7-yl)-5-(butylsulfanylmethyl)oxolane-3,4-diol, 7-(5-S-Butyl-5-thiopentofuranosyl)-7H-pyrrolo[2,3-d]pyrimidin-4-amine
| Molecular Formula | C15H22N4O3S |
|---|---|
| Molecular Weight | 338.14 g/mol |
| LogP | 0.7 |
| Topological Polar Surface Area | 132.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 338.14127 |
| Heavy Atoms | 23 |
| Complexity | 392.0 |
Chemical Identifiers
| CAS Number | 53458-39-2 |
|---|---|
| SMILES | CCCCSCC1C(C(C(O1)N2C=CC3=C(N=CN=C32)N)O)O |
| InChIKey | VDUUBNFVBZIXEO-UHFFFAOYSA-N |
Product Overview
2-(4-Aminopyrrolo[2,3-d]pyrimidin-7-yl)-5-(butylsulfanylmethyl)oxolane-3,4-diol (CAS 53458-39-2), with molecular formula C15H22N4O3S and molecular weight 338.14 g/mol. IUPAC: 2-(4-aminopyrrolo[2,3-d]pyrimidin-7-yl)-5-(butylsulfanylmethyl)oxolane-3,4-diol.
Chemical Property Profile of 2-(4-Aminopyrrolo[2,3-d]pyrimidin-7-yl)-5-(butylsulfanylmethyl)oxolane-3,4-diol
Property Insights of 2-(4-Aminopyrrolo[2,3-d]pyrimidin-7-yl)-5-(butylsulfanylmethyl)oxolane-3,4-diol
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(4-Aminopyrrolo[2,3-d]pyrimidin-7-yl)-5-(butylsulfanylmethyl)oxolane-3,4-diol. The TPSA of 132.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(4-Aminopyrrolo[2,3-d]pyrimidin-7-yl)-5-(butylsulfanylmethyl)oxolane-3,4-diol. Following Lipinski's Rule of Five, 2-(4-Aminopyrrolo[2,3-d]pyrimidin-7-yl)-5-(butylsulfanylmethyl)oxolane-3,4-diol has 3 hydrogen bond donor(s) and 7 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 2-(4-Aminopyrrolo[2,3-d]pyrimidin-7-yl)-5-(butylsulfanylmethyl)oxolane-3,4-diol?
The CAS number of 2-(4-Aminopyrrolo[2,3-d]pyrimidin-7-yl)-5-(butylsulfanylmethyl)oxolane-3,4-diol is 53458-39-2.
What is the molecular formula of 2-(4-Aminopyrrolo[2,3-d]pyrimidin-7-yl)-5-(butylsulfanylmethyl)oxolane-3,4-diol?
The molecular formula of 2-(4-Aminopyrrolo[2,3-d]pyrimidin-7-yl)-5-(butylsulfanylmethyl)oxolane-3,4-diol is C15H22N4O3S.
What is the molecular weight of 2-(4-Aminopyrrolo[2,3-d]pyrimidin-7-yl)-5-(butylsulfanylmethyl)oxolane-3,4-diol?
The molecular weight of 2-(4-Aminopyrrolo[2,3-d]pyrimidin-7-yl)-5-(butylsulfanylmethyl)oxolane-3,4-diol is 338.14 g/mol.
Where can I buy 2-(4-Aminopyrrolo[2,3-d]pyrimidin-7-yl)-5-(butylsulfanylmethyl)oxolane-3,4-diol?
You can request a quote for 2-(4-Aminopyrrolo[2,3-d]pyrimidin-7-yl)-5-(butylsulfanylmethyl)oxolane-3,4-diol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(4-Aminopyrrolo[2,3-d]pyrimidin-7-yl)-5-(butylsulfanylmethyl)oxolane-3,4-diol?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-Aminopyrrolo[2,3-d]pyrimidin-7-yl)-5-(butylsulfanylmethyl)oxolane-3,4-diol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.