Benzanilide, 3-(bis(2-chloroethyl)amino)-
TL;DR: Benzanilide, 3-(bis(2-chloroethyl)amino)- (CAS 69884-94-2) is a chemical compound with molecular formula C17H18Cl2N2O and molecular weight 336.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[bis(2-chloroethyl)amino]-N-phenylbenzamide
Also Known As: 3-(Bis(2-chloroethyl)amino)benzamide, BENZANILIDE, 3-(BIS(2-CHLOROETHYL)AMINO)-, 3-[bis(2-chloroethyl)amino]-N-phenylbenzamide, 3-[Bis(2-chloroethyl)amino]benzanilide, N-Phenyl-3-[bis(2-chloroethyl)amino]benzamide
| Molecular Formula | C17H18Cl2N2O |
|---|---|
| Molecular Weight | 336.08 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 32.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 7 |
| Exact Mass | 336.07962 |
| Heavy Atoms | 22 |
| Complexity | 329.0 |
Chemical Identifiers
| CAS Number | 69884-94-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)NC(=O)C2=CC(=CC=C2)N(CCCl)CCCl |
| InChIKey | NDIOTDBCSWYSBF-UHFFFAOYSA-N |
Product Overview
Benzanilide, 3-(bis(2-chloroethyl)amino)- (CAS 69884-94-2), with molecular formula C17H18Cl2N2O and molecular weight 336.08 g/mol. IUPAC: 3-[bis(2-chloroethyl)amino]-N-phenylbenzamide.
Chemical Property Profile of Benzanilide, 3-(bis(2-chloroethyl)amino)-
Property Insights of Benzanilide, 3-(bis(2-chloroethyl)amino)-
The XLogP value of 3.9 indicates that Benzanilide, 3-(bis(2-chloroethyl)amino)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 32.3 Ų, Benzanilide, 3-(bis(2-chloroethyl)amino)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzanilide, 3-(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 Benzanilide, 3-(bis(2-chloroethyl)amino)-?
The CAS number of Benzanilide, 3-(bis(2-chloroethyl)amino)- is 69884-94-2.
What is the molecular formula of Benzanilide, 3-(bis(2-chloroethyl)amino)-?
The molecular formula of Benzanilide, 3-(bis(2-chloroethyl)amino)- is C17H18Cl2N2O.
What is the molecular weight of Benzanilide, 3-(bis(2-chloroethyl)amino)-?
The molecular weight of Benzanilide, 3-(bis(2-chloroethyl)amino)- is 336.08 g/mol.
Where can I buy Benzanilide, 3-(bis(2-chloroethyl)amino)-?
You can request a quote for Benzanilide, 3-(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 Benzanilide, 3-(bis(2-chloroethyl)amino)-?
Yes, KEHONG BIO provides custom synthesis services for Benzanilide, 3-(bis(2-chloroethyl)amino)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.