C20H25NO8
TL;DR: C20H25NO8 (CAS 447458-28-8) is a chemical compound with molecular formula C20H25NO8 and molecular weight 407.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methyl-3-[[(1S,2R,6R,8S,9R)-4,4,11,11-tetramethyl-3,5,7,10,12-pentaoxatricyclo[7.3.0.02,6]dodecane-8-carbonyl]amino]benzoic acid
Also Known As: 4-methyl-3-((3aR,5S,5aR,8aS,8bR)-2,2,7,7-tetramethyltetrahydro-3aH-bis([1,3]dioxolo)[4,5-b:4',5'-d]pyran-5-carboxamido)benzoic acid, 4-methyl-3-({[(3aR,5S,5aR,8aS,8bR)-2,2,7,7-tetramethyltetrahydro-3aH-bis[1,3]dioxolo[4,5-b:4',5'-d]pyran-5-yl]carbonyl}amino)benzoic acid (non-preferred name)
| Molecular Formula | C20H25NO8 |
|---|---|
| Molecular Weight | 407.16 g/mol |
| LogP | 2.02822 |
| Topological Polar Surface Area | 112.55 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 407.15802 |
| Heavy Atoms | 29 |
| Complexity | 850.883 |
Chemical Identifiers
| CAS Number | 447458-28-8 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)C(=O)O)NC(=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
C20H25NO8 (CAS 447458-28-8), with molecular formula C20H25NO8 and molecular weight 407.16 g/mol. IUPAC: 4-methyl-3-[[(1S,2R,6R,8S,9R)-4,4,11,11-tetramethyl-3,5,7,10,12-pentaoxatricyclo[7.3.0.02,6]dodecane-8-carbonyl]amino]benzoic acid.
Chemical Property Profile of C20H25NO8
Property Insights of C20H25NO8
The XLogP value of 2.02822 suggests moderate lipophilicity, balancing water solubility and membrane permeability for C20H25NO8. The TPSA of 112.55 Ų falls within the moderate polarity range, balancing permeability and solubility for C20H25NO8. Following Lipinski's Rule of Five, C20H25NO8 has 2 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 C20H25NO8?
The CAS number of C20H25NO8 is 447458-28-8.
What is the molecular formula of C20H25NO8?
The molecular formula of C20H25NO8 is C20H25NO8.
What is the molecular weight of C20H25NO8?
The molecular weight of C20H25NO8 is 407.16 g/mol.
Where can I buy C20H25NO8?
You can request a quote for C20H25NO8 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C20H25NO8?
Yes, KEHONG BIO provides custom synthesis services for C20H25NO8 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.