N,N'-(2-Chloro-1,4-phenylene)bis(3-oxobutaneamide)
TL;DR: N,N'-(2-Chloro-1,4-phenylene)bis(3-oxobutaneamide) (CAS 53641-10-4) is a chemical compound with molecular formula C14H15ClN2O4 and molecular weight 310.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[3-chloro-4-(3-oxobutanoylamino)phenyl]-3-oxobutanamide
Also Known As: N,N'-(2-Chloro-1,4-phenylene)bis[3-oxobutanamide], BIM-0016733.P001, N,N'-(2-chloro-1,4-phenylene)bis(3-oxobutanamide), EC 443-010-4, N-[3-chloro-4-(3-oxobutanoylamino)phenyl]-3-oxobutanamide
| Molecular Formula | C14H15ClN2O4 |
|---|---|
| Molecular Weight | 310.07 g/mol |
| LogP | 2.1752 |
| Topological Polar Surface Area | 92.34 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 310.07202 |
| Heavy Atoms | 21 |
| Complexity | 598.63684 |
Chemical Identifiers
| CAS Number | 53641-10-4 |
|---|---|
| SMILES | CC(=O)CC(=O)NC1=CC(=C(C=C1)NC(=O)CC(=O)C)Cl |
Product Overview
N,N'-(2-Chloro-1,4-phenylene)bis(3-oxobutaneamide) (CAS 53641-10-4), with molecular formula C14H15ClN2O4 and molecular weight 310.07 g/mol. IUPAC: N-[3-chloro-4-(3-oxobutanoylamino)phenyl]-3-oxobutanamide.
Chemical Property Profile of N,N'-(2-Chloro-1,4-phenylene)bis(3-oxobutaneamide)
Property Insights of N,N'-(2-Chloro-1,4-phenylene)bis(3-oxobutaneamide)
The XLogP value of 2.1752 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N,N'-(2-Chloro-1,4-phenylene)bis(3-oxobutaneamide). The TPSA of 92.34 Ų falls within the moderate polarity range, balancing permeability and solubility for N,N'-(2-Chloro-1,4-phenylene)bis(3-oxobutaneamide). Following Lipinski's Rule of Five, N,N'-(2-Chloro-1,4-phenylene)bis(3-oxobutaneamide) 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-Chloro-1,4-phenylene)bis(3-oxobutaneamide)?
The CAS number of N,N'-(2-Chloro-1,4-phenylene)bis(3-oxobutaneamide) is 53641-10-4.
What is the molecular formula of N,N'-(2-Chloro-1,4-phenylene)bis(3-oxobutaneamide)?
The molecular formula of N,N'-(2-Chloro-1,4-phenylene)bis(3-oxobutaneamide) is C14H15ClN2O4.
What is the molecular weight of N,N'-(2-Chloro-1,4-phenylene)bis(3-oxobutaneamide)?
The molecular weight of N,N'-(2-Chloro-1,4-phenylene)bis(3-oxobutaneamide) is 310.07 g/mol.
Where can I buy N,N'-(2-Chloro-1,4-phenylene)bis(3-oxobutaneamide)?
You can request a quote for N,N'-(2-Chloro-1,4-phenylene)bis(3-oxobutaneamide) 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-Chloro-1,4-phenylene)bis(3-oxobutaneamide)?
Yes, KEHONG BIO provides custom synthesis services for N,N'-(2-Chloro-1,4-phenylene)bis(3-oxobutaneamide) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.