![[5-(6-氨基嘌呤-9-基)-3-羟基氧杂环戊-2-基]甲基4-甲基苯磺酸酯 structure](/static/products/6698/6698-29-9.webp)
[5-(6-氨基嘌呤-9-基)-3-羟基氧杂环戊-2-基]甲基4-甲基苯磺酸酯
TL;DR: [5-(6-氨基嘌呤-9-基)-3-羟基氧杂环戊-2-基]甲基4-甲基苯磺酸酯 (CAS 6698-29-9) is a chemical compound with molecular formula C17H19N5O5S and molecular weight 405.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[5-(6-氨基嘌呤-9-基)-3-羟基氧杂环戊-2-基]甲基4-甲基苯磺酸酯
[5-(6-aminopurin-9-yl)-3-hydroxyoxolan-2-yl]methyl 4-methylbenzenesulfonate
Also Known As: 5-(6-aminopurin-9-yl)-2-[(4-methylphenyl)sulfonyloxymethyl]oxolan-3-ol, [5-(6-aminopurin-9-yl)-3-hydroxyoxolan-2-yl]methyl 4-methylbenzenesulfonate, 2 inverted exclamation marka-Deoxyadenosine 5 inverted exclamation marka-p-toluenesulfonate, 5 inverted exclamation marka-O-Tosyl-2 inverted exclamation marka-deoxyadenosine, ((2R,3S,5R)-5-(6-Amino-9H-purin-9-yl)-3-hydroxytetrahydrofuran-2-yl)methyl 4-methylbenzenesulfonate
| Molecular Formula | C17H19N5O5S |
|---|---|
| Molecular Weight | 405.11 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 151.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 5 |
| Exact Mass | 405.1107 |
| Heavy Atoms | 28 |
| Complexity | 638.0 |
Chemical Identifiers
| CAS Number | 6698-29-9 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)OCC2C(CC(O2)N3C=NC4=C(N=CN=C43)N)O |
| InChIKey | JBDNXJYWAILXSS-UHFFFAOYSA-N |
Product Overview
[5-(6-氨基嘌呤-9-基)-3-羟基氧杂环戊-2-基]甲基4-甲基苯磺酸酯 (CAS 6698-29-9), with molecular formula C17H19N5O5S and molecular weight 405.11 g/mol. IUPAC: [5-(6-aminopurin-9-yl)-3-hydroxyoxolan-2-yl]methyl 4-methylbenzenesulfonate.
Chemical Property Profile of [5-(6-氨基嘌呤-9-基)-3-羟基氧杂环戊-2-基]甲基4-甲基苯磺酸酯
Property Insights of [5-(6-氨基嘌呤-9-基)-3-羟基氧杂环戊-2-基]甲基4-甲基苯磺酸酯
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [5-(6-氨基嘌呤-9-基)-3-羟基氧杂环戊-2-基]甲基4-甲基苯磺酸酯. The TPSA of 151.0 Ų indicates high polarity, suggesting [5-(6-氨基嘌呤-9-基)-3-羟基氧杂环戊-2-基]甲基4-甲基苯磺酸酯 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, [5-(6-氨基嘌呤-9-基)-3-羟基氧杂环戊-2-基]甲基4-甲基苯磺酸酯 has 2 hydrogen bond donor(s) and 9 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 [5-(6-氨基嘌呤-9-基)-3-羟基氧杂环戊-2-基]甲基4-甲基苯磺酸酯?
The CAS number of [5-(6-氨基嘌呤-9-基)-3-羟基氧杂环戊-2-基]甲基4-甲基苯磺酸酯 is 6698-29-9.
What is the molecular formula of [5-(6-氨基嘌呤-9-基)-3-羟基氧杂环戊-2-基]甲基4-甲基苯磺酸酯?
The molecular formula of [5-(6-氨基嘌呤-9-基)-3-羟基氧杂环戊-2-基]甲基4-甲基苯磺酸酯 is C17H19N5O5S.
What is the molecular weight of [5-(6-氨基嘌呤-9-基)-3-羟基氧杂环戊-2-基]甲基4-甲基苯磺酸酯?
The molecular weight of [5-(6-氨基嘌呤-9-基)-3-羟基氧杂环戊-2-基]甲基4-甲基苯磺酸酯 is 405.11 g/mol.
Where can I buy [5-(6-氨基嘌呤-9-基)-3-羟基氧杂环戊-2-基]甲基4-甲基苯磺酸酯?
You can request a quote for [5-(6-氨基嘌呤-9-基)-3-羟基氧杂环戊-2-基]甲基4-甲基苯磺酸酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [5-(6-氨基嘌呤-9-基)-3-羟基氧杂环戊-2-基]甲基4-甲基苯磺酸酯?
Yes, KEHONG BIO provides custom synthesis services for [5-(6-氨基嘌呤-9-基)-3-羟基氧杂环戊-2-基]甲基4-甲基苯磺酸酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.