4-(Benzylselanyl)-7-pentofuranosyl-7h-pyrrolo[2,3-d]pyrimidine
TL;DR: 4-(Benzylselanyl)-7-pentofuranosyl-7h-pyrrolo[2,3-d]pyrimidine (CAS 6135-43-9) is a chemical compound with molecular formula C18H19N3O4Se and molecular weight 421.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-benzylselanylpyrrolo[2,3-d]pyrimidin-7-yl)-5-(hydroxymethyl)oxolane-3,4-diol
Also Known As: 4-(benzylselanyl)-7-pentofuranosyl-7h-pyrrolo[2,3-d]pyrimidine, 2-(4-benzylselanylpyrrolo[2,3-d]pyrimidin-7-yl)-5-(hydroxymethyl)oxolane-3,4-diol
| Molecular Formula | C18H19N3O4Se |
|---|---|
| Molecular Weight | 421.05 g/mol |
| LogP | -0.4275 |
| Topological Polar Surface Area | 101.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 421.05408 |
| Heavy Atoms | 26 |
| Complexity | 468.0 |
Chemical Identifiers
| CAS Number | 6135-43-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)C[Se]C2=NC=NC3=C2C=CN3C4C(C(C(O4)CO)O)O |
| InChIKey | JFEVQQLQJLXYKH-UHFFFAOYSA-N |
Product Overview
4-(Benzylselanyl)-7-pentofuranosyl-7h-pyrrolo[2,3-d]pyrimidine (CAS 6135-43-9), with molecular formula C18H19N3O4Se and molecular weight 421.05 g/mol. IUPAC: 2-(4-benzylselanylpyrrolo[2,3-d]pyrimidin-7-yl)-5-(hydroxymethyl)oxolane-3,4-diol.
Chemical Property Profile of 4-(Benzylselanyl)-7-pentofuranosyl-7h-pyrrolo[2,3-d]pyrimidine
Property Insights of 4-(Benzylselanyl)-7-pentofuranosyl-7h-pyrrolo[2,3-d]pyrimidine
The XLogP value of -0.4275 indicates that 4-(Benzylselanyl)-7-pentofuranosyl-7h-pyrrolo[2,3-d]pyrimidine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 101.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(Benzylselanyl)-7-pentofuranosyl-7h-pyrrolo[2,3-d]pyrimidine. Following Lipinski's Rule of Five, 4-(Benzylselanyl)-7-pentofuranosyl-7h-pyrrolo[2,3-d]pyrimidine 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
Frequently Asked Questions
What is the CAS number of 4-(Benzylselanyl)-7-pentofuranosyl-7h-pyrrolo[2,3-d]pyrimidine?
The CAS number of 4-(Benzylselanyl)-7-pentofuranosyl-7h-pyrrolo[2,3-d]pyrimidine is 6135-43-9.
What is the molecular formula of 4-(Benzylselanyl)-7-pentofuranosyl-7h-pyrrolo[2,3-d]pyrimidine?
The molecular formula of 4-(Benzylselanyl)-7-pentofuranosyl-7h-pyrrolo[2,3-d]pyrimidine is C18H19N3O4Se.
What is the molecular weight of 4-(Benzylselanyl)-7-pentofuranosyl-7h-pyrrolo[2,3-d]pyrimidine?
The molecular weight of 4-(Benzylselanyl)-7-pentofuranosyl-7h-pyrrolo[2,3-d]pyrimidine is 421.05 g/mol.
Where can I buy 4-(Benzylselanyl)-7-pentofuranosyl-7h-pyrrolo[2,3-d]pyrimidine?
You can request a quote for 4-(Benzylselanyl)-7-pentofuranosyl-7h-pyrrolo[2,3-d]pyrimidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(Benzylselanyl)-7-pentofuranosyl-7h-pyrrolo[2,3-d]pyrimidine?
Yes, KEHONG BIO provides custom synthesis services for 4-(Benzylselanyl)-7-pentofuranosyl-7h-pyrrolo[2,3-d]pyrimidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.