AO-990/15068180
TL;DR: AO-990/15068180 (CAS 453582-55-3) is a chemical compound with molecular formula C20H25NO7S and molecular weight 423.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dimethyl 5-[(7,7-dimethyl-2-oxo-1-bicyclo[2.2.1]heptanyl)methylsulfonylamino]benzene-1,3-dicarboxylate
Also Known As: AO-990/15068180, METHYL 5-((((7,7-DIMETHYL-2-OXOBICYCLO[2.2.1]HEPTYL)METHYL)SULFONYL)AMINO)-3-(METHOXYCARBONYL)BENZOATE, Dimethyl 5-(((7,7-dimethyl-2-oxobicyclo[2.2.1]heptan-1-yl)methyl)sulfonamido)isophthalate, 1,3-dimethyl 5-({7,7-dimethyl-2-oxobicyclo[2.2.1]heptan-1-yl}methanesulfonamido)benzene-1,3-dicarboxylate, dimethyl 5-({[(7,7-dimethyl-2-oxobicyclo[2.2.1]hept-1-yl)methyl]sulfonyl}amino)isophthalate
| Molecular Formula | C20H25NO7S |
|---|---|
| Molecular Weight | 423.14 g/mol |
| LogP | 2.3969 |
| Topological Polar Surface Area | 115.84 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 423.13516 |
| Heavy Atoms | 29 |
| Complexity | 948.2939 |
Chemical Identifiers
| CAS Number | 453582-55-3 |
|---|---|
| SMILES | CC1(C2CCC1(C(=O)C2)CS(=O)(=O)NC3=CC(=CC(=C3)C(=O)OC)C(=O)OC)C |
Product Overview
AO-990/15068180 (CAS 453582-55-3), with molecular formula C20H25NO7S and molecular weight 423.14 g/mol. IUPAC: dimethyl 5-[(7,7-dimethyl-2-oxo-1-bicyclo[2.2.1]heptanyl)methylsulfonylamino]benzene-1,3-dicarboxylate.
Chemical Property Profile of AO-990/15068180
Property Insights of AO-990/15068180
The XLogP value of 2.3969 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AO-990/15068180. The TPSA of 115.84 Ų falls within the moderate polarity range, balancing permeability and solubility for AO-990/15068180. Following Lipinski's Rule of Five, AO-990/15068180 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 AO-990/15068180?
The CAS number of AO-990/15068180 is 453582-55-3.
What is the molecular formula of AO-990/15068180?
The molecular formula of AO-990/15068180 is C20H25NO7S.
What is the molecular weight of AO-990/15068180?
The molecular weight of AO-990/15068180 is 423.14 g/mol.
Where can I buy AO-990/15068180?
You can request a quote for AO-990/15068180 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AO-990/15068180?
Yes, KEHONG BIO provides custom synthesis services for AO-990/15068180 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.