Azicemicin A
TL;DR: Azicemicin A (CAS 18960-91-3) is a chemical compound with molecular formula C23H25NO9 and molecular weight 459.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,7,8,10,12b-pentahydroxy-9,12-dimethoxy-3-(1-methylaziridin-2-yl)-2,4,4a,5-tetrahydrobenzo[a]anthracene-1,6-dione
Also Known As: Azicemicin A, 3,7,8,10,12b-pentahydroxy-9,12-dimethoxy-3-(1-methylaziridin-2-yl)-2,4,4a,5-tetrahydrobenzo[a]anthracene-1,6-dione, 3,7,8,10,12b-pentahydroxy-9,12-dimethoxy-3-(1-methylaziridin-2-yl)-3,4,4a,12b-tetrahydrotetraphene-1,6(2h,5h)-dione, Benz(a)anthracene-1,6(2H,5H)-dione, 3,4,4a,12b-tetrahydro-9,12-dimethoxy-3-(1-methyl-2-aziridinyl)-3,7,8,10,12b-pentahydroxy-, Benz[a]anthracene-1,6(2H,5H)-dione,3,4,4a,12b-tetrahydro-3,7,8,10,12b-pentahydroxy-9,12-dimethoxy-3-(1-methyl-2-aziridinyl)-(9CI)
| Molecular Formula | C23H25NO9 |
|---|---|
| Molecular Weight | 459.15 g/mol |
| LogP | 0.5 |
| Topological Polar Surface Area | 157.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 3 |
| Exact Mass | 459.15292 |
| Heavy Atoms | 33 |
| Complexity | 839.0 |
Chemical Identifiers
| CAS Number | 18960-91-3 |
|---|---|
| SMILES | CN1CC1C2(CC3CC(=O)C4=C(C5=C(C(=C(C=C5C(=C4C3(C(=O)C2)O)OC)O)OC)O)O)O |
| InChIKey | FGEKNLXFZXJGOO-UHFFFAOYSA-N |
Product Overview
Azicemicin A (CAS 18960-91-3), with molecular formula C23H25NO9 and molecular weight 459.15 g/mol. IUPAC: 3,7,8,10,12b-pentahydroxy-9,12-dimethoxy-3-(1-methylaziridin-2-yl)-2,4,4a,5-tetrahydrobenzo[a]anthracene-1,6-dione.
Chemical Property Profile of Azicemicin A
Property Insights of Azicemicin A
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Azicemicin A. The TPSA of 157.0 Ų indicates high polarity, suggesting Azicemicin A may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Azicemicin A has 5 hydrogen bond donor(s) and 10 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 Azicemicin A?
The CAS number of Azicemicin A is 18960-91-3.
What is the molecular formula of Azicemicin A?
The molecular formula of Azicemicin A is C23H25NO9.
What is the molecular weight of Azicemicin A?
The molecular weight of Azicemicin A is 459.15 g/mol.
Where can I buy Azicemicin A?
You can request a quote for Azicemicin A directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Azicemicin A?
Yes, KEHONG BIO provides custom synthesis services for Azicemicin A and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.