NCI60_003456
TL;DR: NCI60_003456 (CAS 907554-37-4) is a chemical compound with molecular formula C26H16N6O8 and molecular weight 540.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-nitro-2-[4-(7-nitro-3-oxo-4,9-dihydrofuro[3,2-b]quinoxalin-2-yl)phenyl]-4,9-dihydrofuro[3,2-b]quinoxalin-3-one
Also Known As: NCI60_003456, 7-nitro-2-[4-(7-nitro-3-oxo-4,9-dihydrofuro[3,2-b]quinoxalin-2-yl)phenyl]-4,9-dihydrofuro[3,2-b]quinoxalin-3-one, 2,2'-(1,4-Phenylene)bis(7-nitro-2,4-dihydrofuro[2,3-b]quinoxalin-3-ol), 2-[4-(3-hydroxy-7-nitro-2,4-dihydrofuro[3,2-b]quinoxalin-2-yl)phenyl]-7-nitro-2,4-dihydrofuro[3,2-b]quinoxalin-3-ol
| Molecular Formula | C26H16N6O8 |
|---|---|
| Molecular Weight | 540.10 g/mol |
| LogP | 4.1972 |
| Topological Polar Surface Area | 187.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 4 |
| Exact Mass | 540.10297 |
| Heavy Atoms | 40 |
| Complexity | 1634.6606 |
Chemical Identifiers
| CAS Number | 907554-37-4 |
|---|---|
| SMILES | C1=CC(=CC=C1C2C(=O)C3=C(O2)NC4=C(N3)C=CC(=C4)[N+](=O)[O-])C5C(=O)C6=C(O5)NC7=C(N6)C=CC(=C7)[N+](=O)[O-] |
Product Overview
NCI60_003456 (CAS 907554-37-4), with molecular formula C26H16N6O8 and molecular weight 540.10 g/mol. IUPAC: 7-nitro-2-[4-(7-nitro-3-oxo-4,9-dihydrofuro[3,2-b]quinoxalin-2-yl)phenyl]-4,9-dihydrofuro[3,2-b]quinoxalin-3-one.
Chemical Property Profile of NCI60_003456
Property Insights of NCI60_003456
The XLogP value of 4.1972 indicates that NCI60_003456 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 187.0 Ų indicates high polarity, suggesting NCI60_003456 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, NCI60_003456 has 4 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of NCI60_003456?
The CAS number of NCI60_003456 is 907554-37-4.
What is the molecular formula of NCI60_003456?
The molecular formula of NCI60_003456 is C26H16N6O8.
What is the molecular weight of NCI60_003456?
The molecular weight of NCI60_003456 is 540.10 g/mol.
Where can I buy NCI60_003456?
You can request a quote for NCI60_003456 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for NCI60_003456?
Yes, KEHONG BIO provides custom synthesis services for NCI60_003456 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.