N,N'-(2-Methyl-1,4-phenylene)bis(3-oxobutanamide)
TL;DR: N,N'-(2-Methyl-1,4-phenylene)bis(3-oxobutanamide) (CAS 6948-48-7) is a chemical compound with molecular formula C15H18N2O4 and molecular weight 290.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[3-methyl-4-(3-oxobutanoylamino)phenyl]-3-oxobutanamide
Also Known As: N,N'-(2-Methyl-1,4-phenylene)bis(3-oxobutanamide), n,n'-(2-methylbenzene-1,4-diyl)bis(3-oxobutanamide), N-[3-methyl-4-(3-oxobutanoylamino)phenyl]-3-oxobutanamide
| Molecular Formula | C15H18N2O4 |
|---|---|
| Molecular Weight | 290.13 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 92.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 290.12665 |
| Heavy Atoms | 21 |
| Complexity | 433.0 |
Chemical Identifiers
| CAS Number | 6948-48-7 |
|---|---|
| SMILES | CC1=C(C=CC(=C1)NC(=O)CC(=O)C)NC(=O)CC(=O)C |
| InChIKey | PCKFAWMLVBSFPD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N,N'-(2-Methyl-1,4-phenylene)bis(3-oxobutanamide) (CAS 6948-48-7), with molecular formula C15H18N2O4 and molecular weight 290.13 g/mol. IUPAC: N-[3-methyl-4-(3-oxobutanoylamino)phenyl]-3-oxobutanamide.
Chemical Property Profile of N,N'-(2-Methyl-1,4-phenylene)bis(3-oxobutanamide)
Property Insights of N,N'-(2-Methyl-1,4-phenylene)bis(3-oxobutanamide)
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N,N'-(2-Methyl-1,4-phenylene)bis(3-oxobutanamide). The TPSA of 92.3 Ų falls within the moderate polarity range, balancing permeability and solubility for N,N'-(2-Methyl-1,4-phenylene)bis(3-oxobutanamide). Following Lipinski's Rule of Five, N,N'-(2-Methyl-1,4-phenylene)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'-(2-Methyl-1,4-phenylene)bis(3-oxobutanamide)?
The CAS number of N,N'-(2-Methyl-1,4-phenylene)bis(3-oxobutanamide) is 6948-48-7.
What is the molecular formula of N,N'-(2-Methyl-1,4-phenylene)bis(3-oxobutanamide)?
The molecular formula of N,N'-(2-Methyl-1,4-phenylene)bis(3-oxobutanamide) is C15H18N2O4.
What is the molecular weight of N,N'-(2-Methyl-1,4-phenylene)bis(3-oxobutanamide)?
The molecular weight of N,N'-(2-Methyl-1,4-phenylene)bis(3-oxobutanamide) is 290.13 g/mol.
Where can I buy N,N'-(2-Methyl-1,4-phenylene)bis(3-oxobutanamide)?
You can request a quote for N,N'-(2-Methyl-1,4-phenylene)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'-(2-Methyl-1,4-phenylene)bis(3-oxobutanamide)?
Yes, KEHONG BIO provides custom synthesis services for N,N'-(2-Methyl-1,4-phenylene)bis(3-oxobutanamide) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.