F0565-0828
TL;DR: F0565-0828 (CAS 534581-57-2) is a chemical compound with molecular formula C29H23N5O6 and molecular weight 537.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 7-benzyl-6-(2-methyl-3-nitrobenzoyl)imino-2-oxo-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaene-5-carboxylate
Also Known As: F0565-0828, (Z)-ethyl 1-benzyl-2-((2-methyl-3-nitrobenzoyl)imino)-5-oxo-2,5-dihydro-1H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxylate, ethyl (6Z)-7-benzyl-6-[(2-methyl-3-nitrobenzoyl)imino]-2-oxo-1,7,9-triazatricyclo[8.4.0.0^{3,8}]tetradeca-3(8),4,9,11,13-pentaene-5-carboxylate, ethyl 7-benzyl-6-(2-methyl-3-nitrobenzoyl)imino-2-oxo-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaene-5-carboxylate
| Molecular Formula | C29H23N5O6 |
|---|---|
| Molecular Weight | 537.16 g/mol |
| LogP | 3.83192 |
| Topological Polar Surface Area | 138.17 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 537.16486 |
| Heavy Atoms | 40 |
| Complexity | 1942.9642 |
Chemical Identifiers
| CAS Number | 534581-57-2 |
|---|---|
| SMILES | CCOC(=O)C1=CC2=C(N=C3C=CC=CN3C2=O)N(C1=NC(=O)C4=C(C(=CC=C4)[N+](=O)[O-])C)CC5=CC=CC=C5 |
Product Overview
F0565-0828 (CAS 534581-57-2), with molecular formula C29H23N5O6 and molecular weight 537.16 g/mol. IUPAC: ethyl 7-benzyl-6-(2-methyl-3-nitrobenzoyl)imino-2-oxo-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaene-5-carboxylate.
Chemical Property Profile of F0565-0828
Property Insights of F0565-0828
The XLogP value of 3.83192 indicates that F0565-0828 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 138.17 Ų falls within the moderate polarity range, balancing permeability and solubility for F0565-0828. Following Lipinski's Rule of Five, F0565-0828 has 0 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of F0565-0828?
The CAS number of F0565-0828 is 534581-57-2.
What is the molecular formula of F0565-0828?
The molecular formula of F0565-0828 is C29H23N5O6.
What is the molecular weight of F0565-0828?
The molecular weight of F0565-0828 is 537.16 g/mol.
Where can I buy F0565-0828?
You can request a quote for F0565-0828 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0565-0828?
Yes, KEHONG BIO provides custom synthesis services for F0565-0828 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.