Acetanilide, 2-acetamido-4'-(bis(2-chloroethyl)amino)-
TL;DR: Acetanilide, 2-acetamido-4'-(bis(2-chloroethyl)amino)- (CAS 3131-19-9) is a chemical compound with molecular formula C14H19Cl2N3O2 and molecular weight 331.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-acetamido-N-[4-[bis(2-chloroethyl)amino]phenyl]acetamide
Also Known As: 2-Acetamido-4'-(bis(2-chloroethyl)amino)acetanilide, ACETANILIDE, 2-ACETAMIDO-4'-(BIS(2-CHLOROETHYL)AMINO)-, 2-acetamido-N-[4-[bis(2-chloroethyl)amino]phenyl]acetamide, N~2~-Acetyl-N-{4-[bis(2-chloroethyl)amino]phenyl}glycinamide, BRN 2820301
| Molecular Formula | C14H19Cl2N3O2 |
|---|---|
| Molecular Weight | 331.09 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 61.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 8 |
| Exact Mass | 331.08542 |
| Heavy Atoms | 21 |
| Complexity | 328.0 |
Chemical Identifiers
| CAS Number | 3131-19-9 |
|---|---|
| SMILES | CC(=O)NCC(=O)NC1=CC=C(C=C1)N(CCCl)CCCl |
| InChIKey | IZWJPQAMNXCPNA-UHFFFAOYSA-N |
Product Overview
Acetanilide, 2-acetamido-4'-(bis(2-chloroethyl)amino)- (CAS 3131-19-9), with molecular formula C14H19Cl2N3O2 and molecular weight 331.09 g/mol. IUPAC: 2-acetamido-N-[4-[bis(2-chloroethyl)amino]phenyl]acetamide.
Chemical Property Profile of Acetanilide, 2-acetamido-4'-(bis(2-chloroethyl)amino)-
Property Insights of Acetanilide, 2-acetamido-4'-(bis(2-chloroethyl)amino)-
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Acetanilide, 2-acetamido-4'-(bis(2-chloroethyl)amino)-. The TPSA of 61.4 Ų falls within the moderate polarity range, balancing permeability and solubility for Acetanilide, 2-acetamido-4'-(bis(2-chloroethyl)amino)-. Following Lipinski's Rule of Five, Acetanilide, 2-acetamido-4'-(bis(2-chloroethyl)amino)- has 2 hydrogen bond donor(s) and 3 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 Acetanilide, 2-acetamido-4'-(bis(2-chloroethyl)amino)-?
The CAS number of Acetanilide, 2-acetamido-4'-(bis(2-chloroethyl)amino)- is 3131-19-9.
What is the molecular formula of Acetanilide, 2-acetamido-4'-(bis(2-chloroethyl)amino)-?
The molecular formula of Acetanilide, 2-acetamido-4'-(bis(2-chloroethyl)amino)- is C14H19Cl2N3O2.
What is the molecular weight of Acetanilide, 2-acetamido-4'-(bis(2-chloroethyl)amino)-?
The molecular weight of Acetanilide, 2-acetamido-4'-(bis(2-chloroethyl)amino)- is 331.09 g/mol.
Where can I buy Acetanilide, 2-acetamido-4'-(bis(2-chloroethyl)amino)-?
You can request a quote for Acetanilide, 2-acetamido-4'-(bis(2-chloroethyl)amino)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Acetanilide, 2-acetamido-4'-(bis(2-chloroethyl)amino)-?
Yes, KEHONG BIO provides custom synthesis services for Acetanilide, 2-acetamido-4'-(bis(2-chloroethyl)amino)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.