n,n'-[methanediylbis(2-methylbenzene-4,1-diyl)]bis(3-oxobutanamide)
TL;DR: n,n'-[methanediylbis(2-methylbenzene-4,1-diyl)]bis(3-oxobutanamide) (CAS 71655-97-5) is a chemical compound with molecular formula C23H26N2O4 and molecular weight 394.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-methyl-4-[[3-methyl-4-(3-oxobutanoylamino)phenyl]methyl]phenyl]-3-oxobutanamide
Also Known As: n,n'-[methanediylbis(2-methylbenzene-4,1-diyl)]bis(3-oxobutanamide), N,N'-[Methylenebis(2-methyl-4,1-phenylene)]bis(3-oxobutanamide), N-[2-methyl-4-[[3-methyl-4-(3-oxobutanoylamino)phenyl]methyl]phenyl]-3-oxobutanamide, N-[2-methyl-4-[[3-methyl-4-(3-oxobutanoylamino)phenyl]methyl]phenyl]-3-oxo-butanamide
| Molecular Formula | C23H26N2O4 |
|---|---|
| Molecular Weight | 394.19 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 92.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 394.18927 |
| Heavy Atoms | 29 |
| Complexity | 566.0 |
Chemical Identifiers
| CAS Number | 71655-97-5 |
|---|---|
| SMILES | CC1=C(C=CC(=C1)CC2=CC(=C(C=C2)NC(=O)CC(=O)C)C)NC(=O)CC(=O)C |
| InChIKey | WHQUILGEBQKNOH-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
n,n'-[methanediylbis(2-methylbenzene-4,1-diyl)]bis(3-oxobutanamide) (CAS 71655-97-5), with molecular formula C23H26N2O4 and molecular weight 394.19 g/mol. IUPAC: N-[2-methyl-4-[[3-methyl-4-(3-oxobutanoylamino)phenyl]methyl]phenyl]-3-oxobutanamide.
Chemical Property Profile of n,n'-[methanediylbis(2-methylbenzene-4,1-diyl)]bis(3-oxobutanamide)
Property Insights of n,n'-[methanediylbis(2-methylbenzene-4,1-diyl)]bis(3-oxobutanamide)
The XLogP value of 3.7 indicates that n,n'-[methanediylbis(2-methylbenzene-4,1-diyl)]bis(3-oxobutanamide) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 92.3 Ų falls within the moderate polarity range, balancing permeability and solubility for n,n'-[methanediylbis(2-methylbenzene-4,1-diyl)]bis(3-oxobutanamide). Following Lipinski's Rule of Five, n,n'-[methanediylbis(2-methylbenzene-4,1-diyl)]bis(3-oxobutanamide) 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 n,n'-[methanediylbis(2-methylbenzene-4,1-diyl)]bis(3-oxobutanamide)?
The CAS number of n,n'-[methanediylbis(2-methylbenzene-4,1-diyl)]bis(3-oxobutanamide) is 71655-97-5.
What is the molecular formula of n,n'-[methanediylbis(2-methylbenzene-4,1-diyl)]bis(3-oxobutanamide)?
The molecular formula of n,n'-[methanediylbis(2-methylbenzene-4,1-diyl)]bis(3-oxobutanamide) is C23H26N2O4.
What is the molecular weight of n,n'-[methanediylbis(2-methylbenzene-4,1-diyl)]bis(3-oxobutanamide)?
The molecular weight of n,n'-[methanediylbis(2-methylbenzene-4,1-diyl)]bis(3-oxobutanamide) is 394.19 g/mol.
Where can I buy n,n'-[methanediylbis(2-methylbenzene-4,1-diyl)]bis(3-oxobutanamide)?
You can request a quote for n,n'-[methanediylbis(2-methylbenzene-4,1-diyl)]bis(3-oxobutanamide) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for n,n'-[methanediylbis(2-methylbenzene-4,1-diyl)]bis(3-oxobutanamide)?
Yes, KEHONG BIO provides custom synthesis services for n,n'-[methanediylbis(2-methylbenzene-4,1-diyl)]bis(3-oxobutanamide) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.