![1a,2,3,11b-Tetrahydrobenzo[a]oxireno[j]acridine-2,3-diol structure](/static/products/8594/85945-22-8.webp)
1a,2,3,11b-Tetrahydrobenzo[a]oxireno[j]acridine-2,3-diol
TL;DR: 1a,2,3,11b-Tetrahydrobenzo[a]oxireno[j]acridine-2,3-diol (CAS 85945-22-8) 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-10-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[a]oxireno[j]acridine-2,3-diol, Benz(a)oxireno(j)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 | 85945-22-8 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=CC3=NC4=C(C=C32)C5C(O5)C(C4O)O |
| InChIKey | QLNLUXGICLCKIL-UHFFFAOYSA-N |
Product Overview
1a,2,3,11b-Tetrahydrobenzo[a]oxireno[j]acridine-2,3-diol (CAS 85945-22-8), with molecular formula C17H13NO3 and molecular weight 279.09 g/mol. IUPAC: 5-oxa-10-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 1a,2,3,11b-Tetrahydrobenzo[a]oxireno[j]acridine-2,3-diol
Property Insights of 1a,2,3,11b-Tetrahydrobenzo[a]oxireno[j]acridine-2,3-diol
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1a,2,3,11b-Tetrahydrobenzo[a]oxireno[j]acridine-2,3-diol. The TPSA of 65.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 1a,2,3,11b-Tetrahydrobenzo[a]oxireno[j]acridine-2,3-diol. Following Lipinski's Rule of Five, 1a,2,3,11b-Tetrahydrobenzo[a]oxireno[j]acridine-2,3-diol 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 1a,2,3,11b-Tetrahydrobenzo[a]oxireno[j]acridine-2,3-diol?
The CAS number of 1a,2,3,11b-Tetrahydrobenzo[a]oxireno[j]acridine-2,3-diol is 85945-22-8.
What is the molecular formula of 1a,2,3,11b-Tetrahydrobenzo[a]oxireno[j]acridine-2,3-diol?
The molecular formula of 1a,2,3,11b-Tetrahydrobenzo[a]oxireno[j]acridine-2,3-diol is C17H13NO3.
What is the molecular weight of 1a,2,3,11b-Tetrahydrobenzo[a]oxireno[j]acridine-2,3-diol?
The molecular weight of 1a,2,3,11b-Tetrahydrobenzo[a]oxireno[j]acridine-2,3-diol is 279.09 g/mol.
Where can I buy 1a,2,3,11b-Tetrahydrobenzo[a]oxireno[j]acridine-2,3-diol?
You can request a quote for 1a,2,3,11b-Tetrahydrobenzo[a]oxireno[j]acridine-2,3-diol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1a,2,3,11b-Tetrahydrobenzo[a]oxireno[j]acridine-2,3-diol?
Yes, KEHONG BIO provides custom synthesis services for 1a,2,3,11b-Tetrahydrobenzo[a]oxireno[j]acridine-2,3-diol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.