5,8-Isoquinolinedione, 7-(phenylamino)-
TL;DR: 5,8-Isoquinolinedione, 7-(phenylamino)- (CAS 91668-46-1) is a chemical compound with molecular formula C15H10N2O2 and molecular weight 250.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-anilinoisoquinoline-5,8-dione
Also Known As: 7-anilinoisoquinoline-5,8-dione, 5,8-Isoquinolinedione, 7-(phenylamino)-, 5,8-Isoquinolinedione,7-(phenylamino), 7-(Phenylamino)isoquinoline-5,8-dione, J1.173.882F
| Molecular Formula | C15H10N2O2 |
|---|---|
| Molecular Weight | 250.07 g/mol |
| LogP | 2.4566 |
| Topological Polar Surface Area | 59.06 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 250.07423 |
| Heavy Atoms | 19 |
| Complexity | 690.3016 |
Chemical Identifiers
| CAS Number | 91668-46-1 |
|---|---|
| SMILES | C1=CC=C(C=C1)NC2=CC(=O)C3=C(C2=O)C=NC=C3 |
Product Overview
5,8-Isoquinolinedione, 7-(phenylamino)- (CAS 91668-46-1), with molecular formula C15H10N2O2 and molecular weight 250.07 g/mol. IUPAC: 7-anilinoisoquinoline-5,8-dione.
Chemical Property Profile of 5,8-Isoquinolinedione, 7-(phenylamino)-
Property Insights of 5,8-Isoquinolinedione, 7-(phenylamino)-
The XLogP value of 2.4566 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5,8-Isoquinolinedione, 7-(phenylamino)-. With a topological polar surface area (TPSA) of 59.06 Ų, 5,8-Isoquinolinedione, 7-(phenylamino)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5,8-Isoquinolinedione, 7-(phenylamino)- has 1 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 5,8-Isoquinolinedione, 7-(phenylamino)-?
The CAS number of 5,8-Isoquinolinedione, 7-(phenylamino)- is 91668-46-1.
What is the molecular formula of 5,8-Isoquinolinedione, 7-(phenylamino)-?
The molecular formula of 5,8-Isoquinolinedione, 7-(phenylamino)- is C15H10N2O2.
What is the molecular weight of 5,8-Isoquinolinedione, 7-(phenylamino)-?
The molecular weight of 5,8-Isoquinolinedione, 7-(phenylamino)- is 250.07 g/mol.
Where can I buy 5,8-Isoquinolinedione, 7-(phenylamino)-?
You can request a quote for 5,8-Isoquinolinedione, 7-(phenylamino)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5,8-Isoquinolinedione, 7-(phenylamino)-?
Yes, KEHONG BIO provides custom synthesis services for 5,8-Isoquinolinedione, 7-(phenylamino)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.