N,N-bis(2-chloroethyl)-4-(cyclopropyliminomethyl)-3-methylaniline
TL;DR: N,N-bis(2-chloroethyl)-4-(cyclopropyliminomethyl)-3-methylaniline (CAS 94204-74-7) is a chemical compound with molecular formula C15H20Cl2N2 and molecular weight 298.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,N-bis(2-chloroethyl)-4-(cyclopropyliminomethyl)-3-methylaniline
Also Known As: N,N-bis(2-chloroethyl)-4-(cyclopropyliminomethyl)-3-methylaniline
| Molecular Formula | C15H20Cl2N2 |
|---|---|
| Molecular Weight | 298.10 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 15.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 7 |
| Exact Mass | 298.10034 |
| Heavy Atoms | 19 |
| Complexity | 286.0 |
Chemical Identifiers
| CAS Number | 94204-74-7 |
|---|---|
| SMILES | CC1=C(C=CC(=C1)N(CCCl)CCCl)C=NC2CC2 |
| InChIKey | DXRIJJTXMWSEOI-UHFFFAOYSA-N |
Product Overview
N,N-bis(2-chloroethyl)-4-(cyclopropyliminomethyl)-3-methylaniline (CAS 94204-74-7), with molecular formula C15H20Cl2N2 and molecular weight 298.10 g/mol. IUPAC: N,N-bis(2-chloroethyl)-4-(cyclopropyliminomethyl)-3-methylaniline.
Chemical Property Profile of N,N-bis(2-chloroethyl)-4-(cyclopropyliminomethyl)-3-methylaniline
Property Insights of N,N-bis(2-chloroethyl)-4-(cyclopropyliminomethyl)-3-methylaniline
The XLogP value of 3.7 indicates that N,N-bis(2-chloroethyl)-4-(cyclopropyliminomethyl)-3-methylaniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 15.6 Ų, N,N-bis(2-chloroethyl)-4-(cyclopropyliminomethyl)-3-methylaniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N,N-bis(2-chloroethyl)-4-(cyclopropyliminomethyl)-3-methylaniline has 0 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 N,N-bis(2-chloroethyl)-4-(cyclopropyliminomethyl)-3-methylaniline?
The CAS number of N,N-bis(2-chloroethyl)-4-(cyclopropyliminomethyl)-3-methylaniline is 94204-74-7.
What is the molecular formula of N,N-bis(2-chloroethyl)-4-(cyclopropyliminomethyl)-3-methylaniline?
The molecular formula of N,N-bis(2-chloroethyl)-4-(cyclopropyliminomethyl)-3-methylaniline is C15H20Cl2N2.
What is the molecular weight of N,N-bis(2-chloroethyl)-4-(cyclopropyliminomethyl)-3-methylaniline?
The molecular weight of N,N-bis(2-chloroethyl)-4-(cyclopropyliminomethyl)-3-methylaniline is 298.10 g/mol.
Where can I buy N,N-bis(2-chloroethyl)-4-(cyclopropyliminomethyl)-3-methylaniline?
You can request a quote for N,N-bis(2-chloroethyl)-4-(cyclopropyliminomethyl)-3-methylaniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N,N-bis(2-chloroethyl)-4-(cyclopropyliminomethyl)-3-methylaniline?
Yes, KEHONG BIO provides custom synthesis services for N,N-bis(2-chloroethyl)-4-(cyclopropyliminomethyl)-3-methylaniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.