p-Toluamide, 3-(bis(2-chloroethyl)amino)-N-ethyl-
TL;DR: p-Toluamide, 3-(bis(2-chloroethyl)amino)-N-ethyl- (CAS 21447-85-8) 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.
3-[bis(2-chloroethyl)amino]-N-ethyl-4-methylbenzamide
Also Known As: 3-(Bis -N-ethyl-p-toluamide, 3-(Bis(2-chloroethyl)amino)-N-ethyl-p-toluamide, p-Toluamide, 3-(bis(2-chloroethyl)amino)-N-ethyl-, 3-[bis(2-chloroethyl)amino]-n-ethyl-4-methylbenzamide, Benzenesulfonic acid,4-methyl-3-nitro-,methyl ester
| Molecular Formula | C14H20Cl2N2O |
|---|---|
| Molecular Weight | 302.10 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 32.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 7 |
| Exact Mass | 302.09528 |
| Heavy Atoms | 19 |
| Complexity | 270.0 |
Chemical Identifiers
| CAS Number | 21447-85-8 |
|---|---|
| SMILES | CCNC(=O)C1=CC(=C(C=C1)C)N(CCCl)CCCl |
| InChIKey | MEGRETRVTYTRSM-UHFFFAOYSA-N |
Product Overview
p-Toluamide, 3-(bis(2-chloroethyl)amino)-N-ethyl- (CAS 21447-85-8), with molecular formula C14H20Cl2N2O and molecular weight 302.10 g/mol. IUPAC: 3-[bis(2-chloroethyl)amino]-N-ethyl-4-methylbenzamide.
Chemical Property Profile of p-Toluamide, 3-(bis(2-chloroethyl)amino)-N-ethyl-
Property Insights of p-Toluamide, 3-(bis(2-chloroethyl)amino)-N-ethyl-
The XLogP value of 3.2 indicates that p-Toluamide, 3-(bis(2-chloroethyl)amino)-N-ethyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 32.3 Ų, p-Toluamide, 3-(bis(2-chloroethyl)amino)-N-ethyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, p-Toluamide, 3-(bis(2-chloroethyl)amino)-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 p-Toluamide, 3-(bis(2-chloroethyl)amino)-N-ethyl-?
The CAS number of p-Toluamide, 3-(bis(2-chloroethyl)amino)-N-ethyl- is 21447-85-8.
What is the molecular formula of p-Toluamide, 3-(bis(2-chloroethyl)amino)-N-ethyl-?
The molecular formula of p-Toluamide, 3-(bis(2-chloroethyl)amino)-N-ethyl- is C14H20Cl2N2O.
What is the molecular weight of p-Toluamide, 3-(bis(2-chloroethyl)amino)-N-ethyl-?
The molecular weight of p-Toluamide, 3-(bis(2-chloroethyl)amino)-N-ethyl- is 302.10 g/mol.
Where can I buy p-Toluamide, 3-(bis(2-chloroethyl)amino)-N-ethyl-?
You can request a quote for p-Toluamide, 3-(bis(2-chloroethyl)amino)-N-ethyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for p-Toluamide, 3-(bis(2-chloroethyl)amino)-N-ethyl-?
Yes, KEHONG BIO provides custom synthesis services for p-Toluamide, 3-(bis(2-chloroethyl)amino)-N-ethyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.