Dibenz(a,j)acridine-3,4-diol, 3,4-dihydro-, trans-
TL;DR: Dibenz(a,j)acridine-3,4-diol, 3,4-dihydro-, trans- (CAS 117019-81-5) is a chemical compound with molecular formula C21H15NO2 and molecular weight 313.1103 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(7S,8S)-13-azapentacyclo[12.8.0.03,12.04,9.017,22]docosa-1,3(12),4(9),5,10,13,15,17,19,21-decaene-7,8-diol
Also Known As: NIOSH/HN1854000, NIOSH/HN1857000, trans-Dibenz(a,j)acridine-3,4-dihydrodiol, Dibenz(a,j)acridine-3,4-diol, 3,4-dihydro-, trans-, 3,4-dihydrodibenzo[a,j]acridine-3,4-diol
Technical Specifications
| Molecular Formula | C21H15NO2 |
| Molecular Weight | 313.1103 g/mol |
| XLogP | 3.6 |
| Topological Polar Surface Area (TPSA) | 53.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 313.1103 Da |
| Heavy Atoms | 24 |
| Complexity | 506.0 |
| SMILES | C1=CC=C2C(=C1)C=CC3=NC4=C(C=C32)C5=C(C=C4)[C@@H]([C@H](C=C5)O)O |
| InChIKey | LWQQPBNWXMYMEF-SFTDATJTSA-N |
Chemical Property Profile of Dibenz(a,j)acridine-3,4-diol, 3,4-dihydro-, trans-
Property Insights of Dibenz(a,j)acridine-3,4-diol, 3,4-dihydro-, trans-
The XLogP value of 3.6 indicates that Dibenz(a,j)acridine-3,4-diol, 3,4-dihydro-, trans- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 53.4 Ų, Dibenz(a,j)acridine-3,4-diol, 3,4-dihydro-, trans- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Dibenz(a,j)acridine-3,4-diol, 3,4-dihydro-, trans- has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Dibenz(a,j)acridine-3,4-diol, 3,4-dihydro-, trans-?
The CAS number of Dibenz(a,j)acridine-3,4-diol, 3,4-dihydro-, trans- is 117019-81-5.
What is the molecular formula of Dibenz(a,j)acridine-3,4-diol, 3,4-dihydro-, trans-?
The molecular formula of Dibenz(a,j)acridine-3,4-diol, 3,4-dihydro-, trans- is C21H15NO2.
What is the molecular weight of Dibenz(a,j)acridine-3,4-diol, 3,4-dihydro-, trans-?
The molecular weight of Dibenz(a,j)acridine-3,4-diol, 3,4-dihydro-, trans- is 313.1103 g/mol.
Where can I buy Dibenz(a,j)acridine-3,4-diol, 3,4-dihydro-, trans-?
You can request a quote for Dibenz(a,j)acridine-3,4-diol, 3,4-dihydro-, trans- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Dibenz(a,j)acridine-3,4-diol, 3,4-dihydro-, trans-?
Yes, CoreyChem provides custom synthesis services for Dibenz(a,j)acridine-3,4-diol, 3,4-dihydro-, trans- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.