4-N,N-Bis(2-hydroxyethyl)aminobutyrophenone
TL;DR: 4-N,N-Bis(2-hydroxyethyl)aminobutyrophenone (CAS 59486-24-7) is a chemical compound with molecular formula C14H21NO3 and molecular weight 251.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[4-[bis(2-hydroxyethyl)amino]phenyl]butan-1-one
Also Known As: 4'-(Bis(2-hydroxyethyl)amino)butyrophenone, 4-N,N-BIS(2-HYDROXYETHYL)AMINOBUTYROPHENONE, 1-(4-(Bis(2-hydroxyethyl)amino)phenyl)-1-butanone, 1-[4-(bis(2-hydroxyethyl)amino)phenyl]butan-1-one, 1-[4-[bis(2-hydroxyethyl)amino]phenyl]butan-1-one
| Molecular Formula | C14H21NO3 |
|---|---|
| Molecular Weight | 251.15 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 60.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 251.15215 |
| Heavy Atoms | 18 |
| Complexity | 231.0 |
Chemical Identifiers
| CAS Number | 59486-24-7 |
|---|---|
| SMILES | CCCC(=O)C1=CC=C(C=C1)N(CCO)CCO |
| InChIKey | UTBJDLRJDZIZIF-UHFFFAOYSA-N |
Product Overview
4-N,N-Bis(2-hydroxyethyl)aminobutyrophenone (CAS 59486-24-7), with molecular formula C14H21NO3 and molecular weight 251.15 g/mol. IUPAC: 1-[4-[bis(2-hydroxyethyl)amino]phenyl]butan-1-one.
Chemical Property Profile of 4-N,N-Bis(2-hydroxyethyl)aminobutyrophenone
Property Insights of 4-N,N-Bis(2-hydroxyethyl)aminobutyrophenone
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-N,N-Bis(2-hydroxyethyl)aminobutyrophenone. The TPSA of 60.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-N,N-Bis(2-hydroxyethyl)aminobutyrophenone. Following Lipinski's Rule of Five, 4-N,N-Bis(2-hydroxyethyl)aminobutyrophenone has 2 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 4-N,N-Bis(2-hydroxyethyl)aminobutyrophenone?
The CAS number of 4-N,N-Bis(2-hydroxyethyl)aminobutyrophenone is 59486-24-7.
What is the molecular formula of 4-N,N-Bis(2-hydroxyethyl)aminobutyrophenone?
The molecular formula of 4-N,N-Bis(2-hydroxyethyl)aminobutyrophenone is C14H21NO3.
What is the molecular weight of 4-N,N-Bis(2-hydroxyethyl)aminobutyrophenone?
The molecular weight of 4-N,N-Bis(2-hydroxyethyl)aminobutyrophenone is 251.15 g/mol.
Where can I buy 4-N,N-Bis(2-hydroxyethyl)aminobutyrophenone?
You can request a quote for 4-N,N-Bis(2-hydroxyethyl)aminobutyrophenone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-N,N-Bis(2-hydroxyethyl)aminobutyrophenone?
Yes, KEHONG BIO provides custom synthesis services for 4-N,N-Bis(2-hydroxyethyl)aminobutyrophenone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.