anti-Dibenz(a,j)acridine-3,4-diol-1,2-epoxide
TL;DR: anti-Dibenz(a,j)acridine-3,4-diol-1,2-epoxide (CAS 105500-28-5) is a chemical compound with molecular formula C21H15NO3 and molecular weight 329.1052 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(18R,19S,20S,22R)-21-oxa-13-azahexacyclo[12.9.0.03,12.04,9.017,23.020,22]tricosa-1(14),2,4,6,8,10,12,15,17(23)-nonaene-18,19-diol
Also Known As: anti-Dibenz(a,j)acridine-3,4-diol-1,2-epoxide, J1.613.198I, 1a-alpha,2-beta,3-alpha,13c-alpha-Tetrahydrobenz(a)oxireno(3,4)benz(1,2-j)acridine-2,3-diol, Benz(a)oxireno(3,4)benz(1,2-j)acridine-2,3-diol, 1a,2,3,13c-tetrahydro-, (1a-alpha,2-beta,3-alpha,13c-alpha)-, (1aalpha,2beta,3alpha,13calpha)-1a,2,3,13c-Tetrahydrobenz(a)oxireno(3,4)benz(1,2-j)acridine-2,3-diol
Technical Specifications
| Molecular Formula | C21H15NO3 |
| Molecular Weight | 329.1052 g/mol |
| XLogP | 2.6 |
| Topological Polar Surface Area (TPSA) | 65.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 329.1052 Da |
| Heavy Atoms | 25 |
| Complexity | 541.0 |
| SMILES | C1=CC=C2C(=C1)C=CC3=NC4=C(C=C32)C5=C(C=C4)[C@H]([C@@H]([C@H]6[C@@H]5O6)O)O |
| InChIKey | PIJVASQAQLIDRI-MHTWAQMVSA-N |
Chemical Property Profile of anti-Dibenz(a,j)acridine-3,4-diol-1,2-epoxide
Property Insights of anti-Dibenz(a,j)acridine-3,4-diol-1,2-epoxide
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for anti-Dibenz(a,j)acridine-3,4-diol-1,2-epoxide. The TPSA of 65.9 Ų falls within the moderate polarity range, balancing permeability and solubility for anti-Dibenz(a,j)acridine-3,4-diol-1,2-epoxide. Following Lipinski's Rule of Five, anti-Dibenz(a,j)acridine-3,4-diol-1,2-epoxide 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
What is the CAS number of anti-Dibenz(a,j)acridine-3,4-diol-1,2-epoxide?
The CAS number of anti-Dibenz(a,j)acridine-3,4-diol-1,2-epoxide is 105500-28-5.
What is the molecular formula of anti-Dibenz(a,j)acridine-3,4-diol-1,2-epoxide?
The molecular formula of anti-Dibenz(a,j)acridine-3,4-diol-1,2-epoxide is C21H15NO3.
What is the molecular weight of anti-Dibenz(a,j)acridine-3,4-diol-1,2-epoxide?
The molecular weight of anti-Dibenz(a,j)acridine-3,4-diol-1,2-epoxide is 329.1052 g/mol.
Where can I buy anti-Dibenz(a,j)acridine-3,4-diol-1,2-epoxide?
You can request a quote for anti-Dibenz(a,j)acridine-3,4-diol-1,2-epoxide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for anti-Dibenz(a,j)acridine-3,4-diol-1,2-epoxide?
Yes, CoreyChem provides custom synthesis services for anti-Dibenz(a,j)acridine-3,4-diol-1,2-epoxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.