O6-环己基甲氧基-2-(4'-氨磺酰苯氨基)嘌呤
TL;DR: O6-环己基甲氧基-2-(4'-氨磺酰苯氨基)嘌呤 (CAS 444722-95-6) is a chemical compound with molecular formula C18H22N6O3S and molecular weight 402.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
O6-环己基甲氧基-2-(4'-氨磺酰苯氨基)嘌呤
4-[[6-(cyclohexylmethoxy)-7H-purin-2-yl]amino]benzenesulfonamide
Also Known As: 4eok, 4eor, 1h1s, 2c6o, 2iw8
| Molecular Formula | C18H22N6O3S |
|---|---|
| Molecular Weight | 402.15 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 144.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 402.1474 |
| Heavy Atoms | 28 |
| Complexity | 601.0 |
Chemical Identifiers
| CAS Number | 444722-95-6 |
|---|---|
| SMILES | C1CCC(CC1)COC2=NC(=NC3=C2NC=N3)NC4=CC=C(C=C4)S(=O)(=O)N |
| InChIKey | OWXORKPNCHJYOF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
O6-环己基甲氧基-2-(4'-氨磺酰苯氨基)嘌呤 (CAS 444722-95-6), with molecular formula C18H22N6O3S and molecular weight 402.15 g/mol. IUPAC: 4-[[6-(cyclohexylmethoxy)-7H-purin-2-yl]amino]benzenesulfonamide.
Chemical Property Profile of O6-环己基甲氧基-2-(4'-氨磺酰苯氨基)嘌呤
Property Insights of O6-环己基甲氧基-2-(4'-氨磺酰苯氨基)嘌呤
The XLogP value of 3.2 indicates that O6-环己基甲氧基-2-(4'-氨磺酰苯氨基)嘌呤 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 144.0 Ų indicates high polarity, suggesting O6-环己基甲氧基-2-(4'-氨磺酰苯氨基)嘌呤 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, O6-环己基甲氧基-2-(4'-氨磺酰苯氨基)嘌呤 has 3 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 O6-环己基甲氧基-2-(4'-氨磺酰苯氨基)嘌呤?
The CAS number of O6-环己基甲氧基-2-(4'-氨磺酰苯氨基)嘌呤 is 444722-95-6.
What is the molecular formula of O6-环己基甲氧基-2-(4'-氨磺酰苯氨基)嘌呤?
The molecular formula of O6-环己基甲氧基-2-(4'-氨磺酰苯氨基)嘌呤 is C18H22N6O3S.
What is the molecular weight of O6-环己基甲氧基-2-(4'-氨磺酰苯氨基)嘌呤?
The molecular weight of O6-环己基甲氧基-2-(4'-氨磺酰苯氨基)嘌呤 is 402.15 g/mol.
Where can I buy O6-环己基甲氧基-2-(4'-氨磺酰苯氨基)嘌呤?
You can request a quote for O6-环己基甲氧基-2-(4'-氨磺酰苯氨基)嘌呤 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for O6-环己基甲氧基-2-(4'-氨磺酰苯氨基)嘌呤?
Yes, KEHONG BIO provides custom synthesis services for O6-环己基甲氧基-2-(4'-氨磺酰苯氨基)嘌呤 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.