C22H31NO7
TL;DR: C22H31NO7 (CAS 449797-04-0) is a chemical compound with molecular formula C22H31NO7 and molecular weight 421.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1S,2R,6R,8S,9R)-N-(2-butoxyphenyl)-4,4,11,11-tetramethyl-3,5,7,10,12-pentaoxatricyclo[7.3.0.02,6]dodecane-8-carboxamide
Also Known As: (3aR,5S,5aR,8aS,8bR)-N-(2-butoxyphenyl)-2,2,7,7-tetramethyltetrahydro-3aH-bis([1,3]dioxolo)[4,5-b:4',5'-d]pyran-5-carboxamide, (3aR,5S,5aR,8aS,8bR)-N-(2-butoxyphenyl)-2,2,7,7-tetramethyltetrahydro-3aH-bis[1,3]dioxolo[4,5-b:4',5'-d]pyran-5-carboxamide (non-preferred name)
| Molecular Formula | C22H31NO7 |
|---|---|
| Molecular Weight | 421.21 g/mol |
| LogP | 3.2005 |
| Topological Polar Surface Area | 84.48 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 421.21005 |
| Heavy Atoms | 30 |
| Complexity | 780.50446 |
Chemical Identifiers
| CAS Number | 449797-04-0 |
|---|---|
| SMILES | CCCCOC1=CC=CC=C1NC(=O)[C@@H]2[C@H]3[C@@H]([C@@H]4[C@H](O2)OC(O4)(C)C)OC(O3)(C)C |
Product Overview
C22H31NO7 (CAS 449797-04-0), with molecular formula C22H31NO7 and molecular weight 421.21 g/mol. IUPAC: (1S,2R,6R,8S,9R)-N-(2-butoxyphenyl)-4,4,11,11-tetramethyl-3,5,7,10,12-pentaoxatricyclo[7.3.0.02,6]dodecane-8-carboxamide.
Chemical Property Profile of C22H31NO7
Property Insights of C22H31NO7
The XLogP value of 3.2005 indicates that C22H31NO7 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 84.48 Ų falls within the moderate polarity range, balancing permeability and solubility for C22H31NO7. Following Lipinski's Rule of Five, C22H31NO7 has 1 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 C22H31NO7?
The CAS number of C22H31NO7 is 449797-04-0.
What is the molecular formula of C22H31NO7?
The molecular formula of C22H31NO7 is C22H31NO7.
What is the molecular weight of C22H31NO7?
The molecular weight of C22H31NO7 is 421.21 g/mol.
Where can I buy C22H31NO7?
You can request a quote for C22H31NO7 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C22H31NO7?
Yes, KEHONG BIO provides custom synthesis services for C22H31NO7 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.