N-Butyrylindoline
TL;DR: N-Butyrylindoline (CAS 91639-92-8) is a chemical compound with molecular formula C12H15NO and molecular weight 189.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2,3-dihydroindol-1-yl)butan-1-one
Also Known As: N-BUTYRYLINDOLINE, N-1-butyrylindoline, 1-indolinylbutan-1-one, 1-(2,3-dihydroindol-1-yl)butan-1-one, 1-(2,3-dihydro-1H-indol-1-yl)butan-1-one
| Molecular Formula | C12H15NO |
|---|---|
| Molecular Weight | 189.12 g/mol |
| LogP | 2.3758 |
| Topological Polar Surface Area | 20.31 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 189.11537 |
| Heavy Atoms | 14 |
| Complexity | 345.9299 |
Chemical Identifiers
| CAS Number | 91639-92-8 |
|---|---|
| SMILES | CCCC(=O)N1CCC2=CC=CC=C21 |
Product Overview
N-Butyrylindoline (CAS 91639-92-8), with molecular formula C12H15NO and molecular weight 189.12 g/mol. IUPAC: 1-(2,3-dihydroindol-1-yl)butan-1-one.
Chemical Property Profile of N-Butyrylindoline
Property Insights of N-Butyrylindoline
The XLogP value of 2.3758 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-Butyrylindoline. With a topological polar surface area (TPSA) of 20.31 Ų, N-Butyrylindoline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-Butyrylindoline has 0 hydrogen bond donor(s) and 1 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 N-Butyrylindoline?
The CAS number of N-Butyrylindoline is 91639-92-8.
What is the molecular formula of N-Butyrylindoline?
The molecular formula of N-Butyrylindoline is C12H15NO.
What is the molecular weight of N-Butyrylindoline?
The molecular weight of N-Butyrylindoline is 189.12 g/mol.
Where can I buy N-Butyrylindoline?
You can request a quote for N-Butyrylindoline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-Butyrylindoline?
Yes, KEHONG BIO provides custom synthesis services for N-Butyrylindoline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.