Acetamide, 2-(p-(bis(2-chloroethyl)amino)phenyl)-N-ethyl-
TL;DR: Acetamide, 2-(p-(bis(2-chloroethyl)amino)phenyl)-N-ethyl- (CAS 40068-20-0) is a chemical compound with molecular formula C14H20Cl2N2O and molecular weight 302.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-[bis(2-chloroethyl)amino]phenyl]-N-ethylacetamide
Also Known As: BCAPAA-aethylamid, Acetamide, 2-(p-(bis(2-chloroethyl)amino)phenyl)-N-ethyl-, 2-(p-(Bis(2-chloroethyl)amino)phenyl)-N-ethylacetamide, 2-{4-[bis(2-chloroethyl)amino]phenyl}-n-ethylacetamide, Benzeneacetamide, 4-(bis(2-chloroethyl)amino)-N-ethyl-
| Molecular Formula | C14H20Cl2N2O |
|---|---|
| Molecular Weight | 302.10 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 32.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 8 |
| Exact Mass | 302.09528 |
| Heavy Atoms | 19 |
| Complexity | 250.0 |
Chemical Identifiers
| CAS Number | 40068-20-0 |
|---|---|
| SMILES | CCNC(=O)CC1=CC=C(C=C1)N(CCCl)CCCl |
| InChIKey | DNWYNHYCHKJTPX-UHFFFAOYSA-N |
Product Overview
Acetamide, 2-(p-(bis(2-chloroethyl)amino)phenyl)-N-ethyl- (CAS 40068-20-0), with molecular formula C14H20Cl2N2O and molecular weight 302.10 g/mol. IUPAC: 2-[4-[bis(2-chloroethyl)amino]phenyl]-N-ethylacetamide.
Chemical Property Profile of Acetamide, 2-(p-(bis(2-chloroethyl)amino)phenyl)-N-ethyl-
Property Insights of Acetamide, 2-(p-(bis(2-chloroethyl)amino)phenyl)-N-ethyl-
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Acetamide, 2-(p-(bis(2-chloroethyl)amino)phenyl)-N-ethyl-. With a topological polar surface area (TPSA) of 32.3 Ų, Acetamide, 2-(p-(bis(2-chloroethyl)amino)phenyl)-N-ethyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Acetamide, 2-(p-(bis(2-chloroethyl)amino)phenyl)-N-ethyl- has 1 hydrogen bond donor(s) and 2 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 Acetamide, 2-(p-(bis(2-chloroethyl)amino)phenyl)-N-ethyl-?
The CAS number of Acetamide, 2-(p-(bis(2-chloroethyl)amino)phenyl)-N-ethyl- is 40068-20-0.
What is the molecular formula of Acetamide, 2-(p-(bis(2-chloroethyl)amino)phenyl)-N-ethyl-?
The molecular formula of Acetamide, 2-(p-(bis(2-chloroethyl)amino)phenyl)-N-ethyl- is C14H20Cl2N2O.
What is the molecular weight of Acetamide, 2-(p-(bis(2-chloroethyl)amino)phenyl)-N-ethyl-?
The molecular weight of Acetamide, 2-(p-(bis(2-chloroethyl)amino)phenyl)-N-ethyl- is 302.10 g/mol.
Where can I buy Acetamide, 2-(p-(bis(2-chloroethyl)amino)phenyl)-N-ethyl-?
You can request a quote for Acetamide, 2-(p-(bis(2-chloroethyl)amino)phenyl)-N-ethyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Acetamide, 2-(p-(bis(2-chloroethyl)amino)phenyl)-N-ethyl-?
Yes, KEHONG BIO provides custom synthesis services for Acetamide, 2-(p-(bis(2-chloroethyl)amino)phenyl)-N-ethyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.