Ccris 5420
TL;DR: Ccris 5420 (CAS 85993-47-1) is a chemical compound with molecular formula C17H13NO3 and molecular weight 279.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-oxa-2-azapentacyclo[9.8.0.03,9.04,6.014,19]nonadeca-1,3(9),10,12,14,16,18-heptaene-7,8-diol
Also Known As: 1a,2,3,11b-tetrahydrobenzo[c]oxireno[h]acridine-2,3-diol, (+-)-8alpha,9beta-Dihydroxy-10beta,11beta-epoxy-8,9,10,11-tetrahydrobenz(c)acridine, (1aalpha,2alpha,3beta,11balpha)-1a,2,3,11b-Tetrahydrobenz(c)oxireno(h)acridine-2,3-diol, 1a,2,3,11b-Tetrahydrobenz(c)oxireno(h)acridine-2,3-diol (1aalpha,2alpha,3beta,11balpha)-, Benz(c)oxireno(h)acridine-2,3-diol, 1a,2,3,11b-tetrahydro-, (1aalpha,2alpha,3beta,11balpha)-
| Molecular Formula | C17H13NO3 |
|---|---|
| Molecular Weight | 279.09 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 65.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 279.08954 |
| Heavy Atoms | 21 |
| Complexity | 430.0 |
Chemical Identifiers
| CAS Number | 85993-47-1 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=CC3=CC4=C(C5C(O5)C(C4O)O)N=C32 |
| InChIKey | NKLDUXQTNCADRF-UHFFFAOYSA-N |
Product Overview
Ccris 5420 (CAS 85993-47-1), with molecular formula C17H13NO3 and molecular weight 279.09 g/mol. IUPAC: 5-oxa-2-azapentacyclo[9.8.0.03,9.04,6.014,19]nonadeca-1,3(9),10,12,14,16,18-heptaene-7,8-diol.
Chemical Property Profile of Ccris 5420
Property Insights of Ccris 5420
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ccris 5420. The TPSA of 65.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Ccris 5420. Following Lipinski's Rule of Five, Ccris 5420 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 5420?
The CAS number of Ccris 5420 is 85993-47-1.
What is the molecular formula of Ccris 5420?
The molecular formula of Ccris 5420 is C17H13NO3.
What is the molecular weight of Ccris 5420?
The molecular weight of Ccris 5420 is 279.09 g/mol.
Where can I buy Ccris 5420?
You can request a quote for Ccris 5420 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ccris 5420?
Yes, KEHONG BIO provides custom synthesis services for Ccris 5420 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.