6-(Butylamino)quinoline-5,8-dione
TL;DR: 6-(Butylamino)quinoline-5,8-dione (CAS 35976-60-4) is a chemical compound with molecular formula C13H14N2O2 and molecular weight 230.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(butylamino)quinoline-5,8-dione
Also Known As: 6-(butylamino)quinoline-5,8-dione, 5, 6-(butylamino)-, 6-(Butylamino)-5,8-quinolinedione, 5,8-Quinolinedione, 6-butylamino-, 6-butylamino-quinoline-5,8-dione
| Molecular Formula | C13H14N2O2 |
|---|---|
| Molecular Weight | 230.11 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 59.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 230.10553 |
| Heavy Atoms | 17 |
| Complexity | 349.0 |
Chemical Identifiers
| CAS Number | 35976-60-4 |
|---|---|
| SMILES | CCCCNC1=CC(=O)C2=C(C1=O)C=CC=N2 |
| InChIKey | IUQRFVREMWMGPS-UHFFFAOYSA-N |
Product Overview
6-(Butylamino)quinoline-5,8-dione (CAS 35976-60-4), with molecular formula C13H14N2O2 and molecular weight 230.11 g/mol. IUPAC: 6-(butylamino)quinoline-5,8-dione.
Chemical Property Profile of 6-(Butylamino)quinoline-5,8-dione
Property Insights of 6-(Butylamino)quinoline-5,8-dione
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-(Butylamino)quinoline-5,8-dione. With a topological polar surface area (TPSA) of 59.1 Ų, 6-(Butylamino)quinoline-5,8-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-(Butylamino)quinoline-5,8-dione 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 6-(Butylamino)quinoline-5,8-dione?
The CAS number of 6-(Butylamino)quinoline-5,8-dione is 35976-60-4.
What is the molecular formula of 6-(Butylamino)quinoline-5,8-dione?
The molecular formula of 6-(Butylamino)quinoline-5,8-dione is C13H14N2O2.
What is the molecular weight of 6-(Butylamino)quinoline-5,8-dione?
The molecular weight of 6-(Butylamino)quinoline-5,8-dione is 230.11 g/mol.
Where can I buy 6-(Butylamino)quinoline-5,8-dione?
You can request a quote for 6-(Butylamino)quinoline-5,8-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-(Butylamino)quinoline-5,8-dione?
Yes, KEHONG BIO provides custom synthesis services for 6-(Butylamino)quinoline-5,8-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.