N,N-bis(2-chloroethyl)-3-methyl-4-[[4-[2-(4-methylphenyl)-1,3-thiazol-4-yl]phenyl]iminomethyl]aniline
TL;DR: N,N-bis(2-chloroethyl)-3-methyl-4-[[4-[2-(4-methylphenyl)-1,3-thiazol-4-yl]phenyl]iminomethyl]aniline (CAS 19749-34-9) is a chemical compound with molecular formula C28H27Cl2N3S and molecular weight 507.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,N-bis(2-chloroethyl)-3-methyl-4-[[4-[2-(4-methylphenyl)-1,3-thiazol-4-yl]phenyl]iminomethyl]aniline
Also Known As: N,N-bis(2-chloroethyl)-3-methyl-4-[[4-[2-(4-methylphenyl)-1,3-thiazol-4-yl]phenyl]iminomethyl]aniline, N,N-Bis(2-chloroethyl)-3-methyl-4-[(E)-({4-[2-(4-methylphenyl)-1,3-thiazol-4-yl]phenyl}imino)methyl]aniline
| Molecular Formula | C28H27Cl2N3S |
|---|---|
| Molecular Weight | 507.13 g/mol |
| LogP | 7.6 |
| Topological Polar Surface Area | 56.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 9 |
| Exact Mass | 507.13028 |
| Heavy Atoms | 34 |
| Complexity | 613.0 |
Chemical Identifiers
| CAS Number | 19749-34-9 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C2=NC(=CS2)C3=CC=C(C=C3)N=CC4=C(C=C(C=C4)N(CCCl)CCCl)C |
| InChIKey | ITGVMXCSYHJOIJ-UHFFFAOYSA-N |
Product Overview
N,N-bis(2-chloroethyl)-3-methyl-4-[[4-[2-(4-methylphenyl)-1,3-thiazol-4-yl]phenyl]iminomethyl]aniline (CAS 19749-34-9), with molecular formula C28H27Cl2N3S and molecular weight 507.13 g/mol. IUPAC: N,N-bis(2-chloroethyl)-3-methyl-4-[[4-[2-(4-methylphenyl)-1,3-thiazol-4-yl]phenyl]iminomethyl]aniline.
Chemical Property Profile of N,N-bis(2-chloroethyl)-3-methyl-4-[[4-[2-(4-methylphenyl)-1,3-thiazol-4-yl]phenyl]iminomethyl]aniline
Property Insights of N,N-bis(2-chloroethyl)-3-methyl-4-[[4-[2-(4-methylphenyl)-1,3-thiazol-4-yl]phenyl]iminomethyl]aniline
The XLogP value of 7.6 indicates that N,N-bis(2-chloroethyl)-3-methyl-4-[[4-[2-(4-methylphenyl)-1,3-thiazol-4-yl]phenyl]iminomethyl]aniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 56.7 Ų, N,N-bis(2-chloroethyl)-3-methyl-4-[[4-[2-(4-methylphenyl)-1,3-thiazol-4-yl]phenyl]iminomethyl]aniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N,N-bis(2-chloroethyl)-3-methyl-4-[[4-[2-(4-methylphenyl)-1,3-thiazol-4-yl]phenyl]iminomethyl]aniline has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N,N-bis(2-chloroethyl)-3-methyl-4-[[4-[2-(4-methylphenyl)-1,3-thiazol-4-yl]phenyl]iminomethyl]aniline?
The CAS number of N,N-bis(2-chloroethyl)-3-methyl-4-[[4-[2-(4-methylphenyl)-1,3-thiazol-4-yl]phenyl]iminomethyl]aniline is 19749-34-9.
What is the molecular formula of N,N-bis(2-chloroethyl)-3-methyl-4-[[4-[2-(4-methylphenyl)-1,3-thiazol-4-yl]phenyl]iminomethyl]aniline?
The molecular formula of N,N-bis(2-chloroethyl)-3-methyl-4-[[4-[2-(4-methylphenyl)-1,3-thiazol-4-yl]phenyl]iminomethyl]aniline is C28H27Cl2N3S.
What is the molecular weight of N,N-bis(2-chloroethyl)-3-methyl-4-[[4-[2-(4-methylphenyl)-1,3-thiazol-4-yl]phenyl]iminomethyl]aniline?
The molecular weight of N,N-bis(2-chloroethyl)-3-methyl-4-[[4-[2-(4-methylphenyl)-1,3-thiazol-4-yl]phenyl]iminomethyl]aniline is 507.13 g/mol.
Where can I buy N,N-bis(2-chloroethyl)-3-methyl-4-[[4-[2-(4-methylphenyl)-1,3-thiazol-4-yl]phenyl]iminomethyl]aniline?
You can request a quote for N,N-bis(2-chloroethyl)-3-methyl-4-[[4-[2-(4-methylphenyl)-1,3-thiazol-4-yl]phenyl]iminomethyl]aniline 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)-3-methyl-4-[[4-[2-(4-methylphenyl)-1,3-thiazol-4-yl]phenyl]iminomethyl]aniline?
Yes, KEHONG BIO provides custom synthesis services for N,N-bis(2-chloroethyl)-3-methyl-4-[[4-[2-(4-methylphenyl)-1,3-thiazol-4-yl]phenyl]iminomethyl]aniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.