Benzamide, 4-(bis(2-chloroethyl)amino)-
TL;DR: Benzamide, 4-(bis(2-chloroethyl)amino)- (CAS 2045-42-3) is a chemical compound with molecular formula C11H14Cl2N2O and molecular weight 260.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[bis(2-chloroethyl)amino]benzamide
Also Known As: 4-[Bis(2-chloroethyl)amino]benzamide, 4-[Bis amino]benzamide, 4-(Bis(2-chloroethyl)amino)benzamide, Benzamide, 4-(bis(2-chloroethyl)amino)-, 3-fluoro-4-hydroxyacetanilide
| Molecular Formula | C11H14Cl2N2O |
|---|---|
| Molecular Weight | 260.05 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 46.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 260.0483 |
| Heavy Atoms | 16 |
| Complexity | 212.0 |
Chemical Identifiers
| CAS Number | 2045-42-3 |
|---|---|
| SMILES | C1=CC(=CC=C1C(=O)N)N(CCCl)CCCl |
| InChIKey | ZNHHOAIGZOAPLA-UHFFFAOYSA-N |
Product Overview
Benzamide, 4-(bis(2-chloroethyl)amino)- (CAS 2045-42-3), with molecular formula C11H14Cl2N2O and molecular weight 260.05 g/mol. IUPAC: 4-[bis(2-chloroethyl)amino]benzamide.
Chemical Property Profile of Benzamide, 4-(bis(2-chloroethyl)amino)-
Property Insights of Benzamide, 4-(bis(2-chloroethyl)amino)-
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzamide, 4-(bis(2-chloroethyl)amino)-. With a topological polar surface area (TPSA) of 46.3 Ų, Benzamide, 4-(bis(2-chloroethyl)amino)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzamide, 4-(bis(2-chloroethyl)amino)- 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 Benzamide, 4-(bis(2-chloroethyl)amino)-?
The CAS number of Benzamide, 4-(bis(2-chloroethyl)amino)- is 2045-42-3.
What is the molecular formula of Benzamide, 4-(bis(2-chloroethyl)amino)-?
The molecular formula of Benzamide, 4-(bis(2-chloroethyl)amino)- is C11H14Cl2N2O.
What is the molecular weight of Benzamide, 4-(bis(2-chloroethyl)amino)-?
The molecular weight of Benzamide, 4-(bis(2-chloroethyl)amino)- is 260.05 g/mol.
Where can I buy Benzamide, 4-(bis(2-chloroethyl)amino)-?
You can request a quote for Benzamide, 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 Benzamide, 4-(bis(2-chloroethyl)amino)-?
Yes, KEHONG BIO provides custom synthesis services for Benzamide, 4-(bis(2-chloroethyl)amino)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.