Lavendamycin
TL;DR: Lavendamycin (CAS 81645-09-2) is a chemical compound with molecular formula C22H14N4O4 and molecular weight 398.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(7-amino-5,8-dioxoquinolin-2-yl)-4-methyl-9H-pyrido[3,4-b]indole-3-carboxylic acid
Also Known As: Lavendamycin, 1-(7-amino-5,8-dioxoquinolin-2-yl)-4-methyl-9H-pyrido[3,4-b]indole-3-carboxylic acid, 9H-Pyrido(3,4-b)indole-3-carboxylic acid, 1-(7-amino-5,8-dihydro-5,8-dioxo-2-quinolinyl)-4-methyl-, 1-(7-amino-5,8-dioxo-5,8-dihydroquinolin-2-yl)-4-methyl-9h-, A-carboline-3-carboxylic acid
| Molecular Formula | C22H14N4O4 |
|---|---|
| Molecular Weight | 398.10 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 139.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 2 |
| Exact Mass | 398.1015 |
| Heavy Atoms | 30 |
| Complexity | 798.0 |
Chemical Identifiers
| CAS Number | 81645-09-2 |
|---|---|
| SMILES | CC1=C2C3=CC=CC=C3NC2=C(N=C1C(=O)O)C4=NC5=C(C=C4)C(=O)C=C(C5=O)N |
| InChIKey | IGQJRDIREIWBQP-UHFFFAOYSA-N |
Product Overview
Lavendamycin (CAS 81645-09-2), with molecular formula C22H14N4O4 and molecular weight 398.10 g/mol. IUPAC: 1-(7-amino-5,8-dioxoquinolin-2-yl)-4-methyl-9H-pyrido[3,4-b]indole-3-carboxylic acid.
Chemical Property Profile of Lavendamycin
Property Insights of Lavendamycin
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Lavendamycin. The TPSA of 139.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Lavendamycin. Following Lipinski's Rule of Five, Lavendamycin has 3 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 Lavendamycin?
The CAS number of Lavendamycin is 81645-09-2.
What is the molecular formula of Lavendamycin?
The molecular formula of Lavendamycin is C22H14N4O4.
What is the molecular weight of Lavendamycin?
The molecular weight of Lavendamycin is 398.10 g/mol.
Where can I buy Lavendamycin?
You can request a quote for Lavendamycin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Lavendamycin?
Yes, KEHONG BIO provides custom synthesis services for Lavendamycin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.