N,N-bis(2-chloroethyl)-4-[(E)-[3-chloro-4-(2-phenylthiazol-4-yl)phenyl]iminomethyl]-3-methyl-aniline
TL;DR: N,N-bis(2-chloroethyl)-4-[(E)-[3-chloro-4-(2-phenylthiazol-4-yl)phenyl]iminomethyl]-3-methyl-aniline (CAS 28284-55-1) is a chemical compound with molecular formula C27H24Cl3N3S and molecular weight 527.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,N-bis(2-chloroethyl)-4-[[3-chloro-4-(2-phenyl-1,3-thiazol-4-yl)phenyl]iminomethyl]-3-methylaniline
Also Known As: N,N-bis(2-chloroethyl)-4-[(E)-[3-chloro-4-(2-phenylthiazol-4-yl)phenyl]iminomethyl]-3-methyl-aniline, N,N-bis(2-chloroethyl)-4-[[3-chloro-4-(2-phenyl-1,3-thiazol-4-yl)phenyl]iminomethyl]-3-methylaniline, N-((1E)-{4-[Bis(2-chloroethyl)amino]-2-methylphenyl}methylene)-3-chloro-4-(2-phenyl-1,3-thiazol-4-yl)aniline
| Molecular Formula | C27H24Cl3N3S |
|---|---|
| Molecular Weight | 527.08 g/mol |
| LogP | 7.9 |
| Topological Polar Surface Area | 56.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 9 |
| Exact Mass | 527.0756 |
| Heavy Atoms | 34 |
| Complexity | 626.0 |
Chemical Identifiers
| CAS Number | 28284-55-1 |
|---|---|
| SMILES | CC1=C(C=CC(=C1)N(CCCl)CCCl)C=NC2=CC(=C(C=C2)C3=CSC(=N3)C4=CC=CC=C4)Cl |
| InChIKey | WMGKVVOOKBZTNM-UHFFFAOYSA-N |
Product Overview
N,N-bis(2-chloroethyl)-4-[(E)-[3-chloro-4-(2-phenylthiazol-4-yl)phenyl]iminomethyl]-3-methyl-aniline (CAS 28284-55-1), with molecular formula C27H24Cl3N3S and molecular weight 527.08 g/mol. IUPAC: N,N-bis(2-chloroethyl)-4-[[3-chloro-4-(2-phenyl-1,3-thiazol-4-yl)phenyl]iminomethyl]-3-methylaniline.
Chemical Property Profile of N,N-bis(2-chloroethyl)-4-[(E)-[3-chloro-4-(2-phenylthiazol-4-yl)phenyl]iminomethyl]-3-methyl-aniline
Property Insights of N,N-bis(2-chloroethyl)-4-[(E)-[3-chloro-4-(2-phenylthiazol-4-yl)phenyl]iminomethyl]-3-methyl-aniline
The XLogP value of 7.9 indicates that N,N-bis(2-chloroethyl)-4-[(E)-[3-chloro-4-(2-phenylthiazol-4-yl)phenyl]iminomethyl]-3-methyl-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)-4-[(E)-[3-chloro-4-(2-phenylthiazol-4-yl)phenyl]iminomethyl]-3-methyl-aniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N,N-bis(2-chloroethyl)-4-[(E)-[3-chloro-4-(2-phenylthiazol-4-yl)phenyl]iminomethyl]-3-methyl-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)-4-[(E)-[3-chloro-4-(2-phenylthiazol-4-yl)phenyl]iminomethyl]-3-methyl-aniline?
The CAS number of N,N-bis(2-chloroethyl)-4-[(E)-[3-chloro-4-(2-phenylthiazol-4-yl)phenyl]iminomethyl]-3-methyl-aniline is 28284-55-1.
What is the molecular formula of N,N-bis(2-chloroethyl)-4-[(E)-[3-chloro-4-(2-phenylthiazol-4-yl)phenyl]iminomethyl]-3-methyl-aniline?
The molecular formula of N,N-bis(2-chloroethyl)-4-[(E)-[3-chloro-4-(2-phenylthiazol-4-yl)phenyl]iminomethyl]-3-methyl-aniline is C27H24Cl3N3S.
What is the molecular weight of N,N-bis(2-chloroethyl)-4-[(E)-[3-chloro-4-(2-phenylthiazol-4-yl)phenyl]iminomethyl]-3-methyl-aniline?
The molecular weight of N,N-bis(2-chloroethyl)-4-[(E)-[3-chloro-4-(2-phenylthiazol-4-yl)phenyl]iminomethyl]-3-methyl-aniline is 527.08 g/mol.
Where can I buy N,N-bis(2-chloroethyl)-4-[(E)-[3-chloro-4-(2-phenylthiazol-4-yl)phenyl]iminomethyl]-3-methyl-aniline?
You can request a quote for N,N-bis(2-chloroethyl)-4-[(E)-[3-chloro-4-(2-phenylthiazol-4-yl)phenyl]iminomethyl]-3-methyl-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)-4-[(E)-[3-chloro-4-(2-phenylthiazol-4-yl)phenyl]iminomethyl]-3-methyl-aniline?
Yes, KEHONG BIO provides custom synthesis services for N,N-bis(2-chloroethyl)-4-[(E)-[3-chloro-4-(2-phenylthiazol-4-yl)phenyl]iminomethyl]-3-methyl-aniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.