![3-[(E)-(butylimino)methyl]quinolin-2(1H)-one structure](/static/products/673/673443-44-2.png)
3-[(E)-(butylimino)methyl]quinolin-2(1H)-one
TL;DR: 3-[(E)-(butylimino)methyl]quinolin-2(1H)-one (CAS 673443-44-2) is a chemical compound with molecular formula C14H16N2O and molecular weight 228.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(butyliminomethyl)-1H-quinolin-2-one
Also Known As: 3-(butylaminomethylidene)quinolin-2-one, (E)-3-((butylimino)methyl)quinolin-2-ol, 3-[(E)-(butylimino)methyl]quinolin-2(1H)-one
| Molecular Formula | C14H16N2O |
|---|---|
| Molecular Weight | 228.13 g/mol |
| LogP | 2.7471 |
| Topological Polar Surface Area | 45.22 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 228.12627 |
| Heavy Atoms | 17 |
| Complexity | 584.03705 |
Chemical Identifiers
| CAS Number | 673443-44-2 |
|---|---|
| SMILES | CCCCN=CC1=CC2=CC=CC=C2NC1=O |
Product Overview
3-[(E)-(butylimino)methyl]quinolin-2(1H)-one (CAS 673443-44-2), with molecular formula C14H16N2O and molecular weight 228.13 g/mol. IUPAC: 3-(butyliminomethyl)-1H-quinolin-2-one.
Chemical Property Profile of 3-[(E)-(butylimino)methyl]quinolin-2(1H)-one
Property Insights of 3-[(E)-(butylimino)methyl]quinolin-2(1H)-one
The XLogP value of 2.7471 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-[(E)-(butylimino)methyl]quinolin-2(1H)-one. With a topological polar surface area (TPSA) of 45.22 Ų, 3-[(E)-(butylimino)methyl]quinolin-2(1H)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-[(E)-(butylimino)methyl]quinolin-2(1H)-one has 1 hydrogen bond donor(s) and 2 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 3-[(E)-(butylimino)methyl]quinolin-2(1H)-one?
The CAS number of 3-[(E)-(butylimino)methyl]quinolin-2(1H)-one is 673443-44-2.
What is the molecular formula of 3-[(E)-(butylimino)methyl]quinolin-2(1H)-one?
The molecular formula of 3-[(E)-(butylimino)methyl]quinolin-2(1H)-one is C14H16N2O.
What is the molecular weight of 3-[(E)-(butylimino)methyl]quinolin-2(1H)-one?
The molecular weight of 3-[(E)-(butylimino)methyl]quinolin-2(1H)-one is 228.13 g/mol.
Where can I buy 3-[(E)-(butylimino)methyl]quinolin-2(1H)-one?
You can request a quote for 3-[(E)-(butylimino)methyl]quinolin-2(1H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[(E)-(butylimino)methyl]quinolin-2(1H)-one?
Yes, KEHONG BIO provides custom synthesis services for 3-[(E)-(butylimino)methyl]quinolin-2(1H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.