Anthramycin 11-methyl ether
TL;DR: Anthramycin 11-methyl ether (CAS 7683-27-4) is a chemical compound with molecular formula C17H19N3O4 and molecular weight 329.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-3-(4-hydroxy-6-methoxy-3-methyl-11-oxo-5,6,6a,7-tetrahydropyrrolo[2,1-c][1,4]benzodiazepin-8-yl)prop-2-enamide
Also Known As: Anthramycin 11-methyl ether, Anthramycin methyl ether, (E)-3-(4-hydroxy-6-methoxy-3-methyl-11-oxo-5,6,6a,7-tetrahydropyrrolo[2,1-c][1,4]benzodiazepin-8-yl)prop-2-enamide, 2-Propenamide, 3-(5,10,11,11a-tetrahydro-9-hydroxy-11-methoxy-8-methyl-5-oxo-1H-pyrrolo(2,1-c)(1,4)benzodiazepin-2-yl)-, (E)-3-(4-hydroxy-6-methoxy-3-methyl-11-oxo-5,6,6a,7-tetrahydropyrrolo[5,1-c][1,4]benzodiazepin-8-yl)prop-2-enamide
| Molecular Formula | C17H19N3O4 |
|---|---|
| Molecular Weight | 329.14 g/mol |
| LogP | 1.23852 |
| Topological Polar Surface Area | 104.89 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 329.13754 |
| Heavy Atoms | 24 |
| Complexity | 769.3443 |
Chemical Identifiers
| CAS Number | 7683-27-4 |
|---|---|
| SMILES | CC1=C(C2=C(C=C1)C(=O)N3C=C(CC3C(N2)OC)/C=C/C(=O)N)O |
Product Overview
Anthramycin 11-methyl ether (CAS 7683-27-4), with molecular formula C17H19N3O4 and molecular weight 329.14 g/mol. IUPAC: (E)-3-(4-hydroxy-6-methoxy-3-methyl-11-oxo-5,6,6a,7-tetrahydropyrrolo[2,1-c][1,4]benzodiazepin-8-yl)prop-2-enamide.
Chemical Property Profile of Anthramycin 11-methyl ether
Property Insights of Anthramycin 11-methyl ether
The XLogP value of 1.23852 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Anthramycin 11-methyl ether. The TPSA of 104.89 Ų falls within the moderate polarity range, balancing permeability and solubility for Anthramycin 11-methyl ether. Following Lipinski's Rule of Five, Anthramycin 11-methyl ether has 3 hydrogen bond donor(s) and 5 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 Anthramycin 11-methyl ether?
The CAS number of Anthramycin 11-methyl ether is 7683-27-4.
What is the molecular formula of Anthramycin 11-methyl ether?
The molecular formula of Anthramycin 11-methyl ether is C17H19N3O4.
What is the molecular weight of Anthramycin 11-methyl ether?
The molecular weight of Anthramycin 11-methyl ether is 329.14 g/mol.
Where can I buy Anthramycin 11-methyl ether?
You can request a quote for Anthramycin 11-methyl ether directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Anthramycin 11-methyl ether?
Yes, KEHONG BIO provides custom synthesis services for Anthramycin 11-methyl ether and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.