Ccris 5867
TL;DR: Ccris 5867 (CAS 87259-00-5) is a chemical compound with molecular formula C18H13NO4 and molecular weight 307.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(8R,9R)-7-nitro-8,9-dihydrobenzo[a]anthracene-8,9-diol
Also Known As: 7-Nitro-8,9-dihydrotetraphene-8,9-diol, 7-Nitrobenz(a)anthracene-trans-8,9-dihydrodiol, (8R,9R)-7-Nitro-8,9-dihydrotetraphene-8,9-diol, 7-NITROBENZ[A]ANTHRACENE-TRANS-8,9-DIHYDRODIOL, (8R,9R)-7-nitro-8,9-dihydrobenzo[a]anthracene-8,9-diol
| Molecular Formula | C18H13NO4 |
|---|---|
| Molecular Weight | 307.08 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 86.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 307.08447 |
| Heavy Atoms | 23 |
| Complexity | 502.0 |
Chemical Identifiers
| CAS Number | 87259-00-5 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=CC3=C2C=C4C=C[C@H]([C@@H](C4=C3[N+](=O)[O-])O)O |
| InChIKey | LREBZIARNANHNE-QAPCUYQASA-N |
Product Overview
Ccris 5867 (CAS 87259-00-5), with molecular formula C18H13NO4 and molecular weight 307.08 g/mol. IUPAC: (8R,9R)-7-nitro-8,9-dihydrobenzo[a]anthracene-8,9-diol.
Chemical Property Profile of Ccris 5867
Property Insights of Ccris 5867
The XLogP value of 3.1 indicates that Ccris 5867 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 86.3 Ų falls within the moderate polarity range, balancing permeability and solubility for Ccris 5867. Following Lipinski's Rule of Five, Ccris 5867 has 2 hydrogen bond donor(s) and 4 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 Ccris 5867?
The CAS number of Ccris 5867 is 87259-00-5.
What is the molecular formula of Ccris 5867?
The molecular formula of Ccris 5867 is C18H13NO4.
What is the molecular weight of Ccris 5867?
The molecular weight of Ccris 5867 is 307.08 g/mol.
Where can I buy Ccris 5867?
You can request a quote for Ccris 5867 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ccris 5867?
Yes, KEHONG BIO provides custom synthesis services for Ccris 5867 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.