![6-[[4-[2-(chloromethyl)-1,3-dioxolan-2-yl]anilino]methyl]-5- structure](/static/products/1886/18861-36-4.webp)
6-[[4-[2-(chloromethyl)-1,3-dioxolan-2-yl]anilino]methyl]-5-
TL;DR: 6-[[4-[2-(chloromethyl)-1,3-dioxolan-2-yl]anilino]methyl]-5- (CAS 18861-36-4) is a chemical compound with molecular formula C21H21Cl2N5O2 and molecular weight 445.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-[[4-[2-(chloromethyl)-1,3-dioxolan-2-yl]anilino]methyl]-5-(4-chlorophenyl)pyrimidine-2,4-diamine
Also Known As: 6-[[4-[2-(chloromethyl)-1,3-dioxolan-2-yl]anilino]methyl]-5-, 6-({4-[2-(Chloromethyl)-1,3-dioxolan-2-yl]anilino}methyl)-5-(4-chlorophenyl)pyrimidine-2,4-diamine, 6-[[4-[2-(chloromethyl)-1,3-dioxolan-2-yl]anilino]methyl]-5-(4-chlorophenyl)pyrimidine-2,4-diamine
| Molecular Formula | C21H21Cl2N5O2 |
|---|---|
| Molecular Weight | 445.11 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 108.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 445.10724 |
| Heavy Atoms | 30 |
| Complexity | 537.0 |
Chemical Identifiers
| CAS Number | 18861-36-4 |
|---|---|
| SMILES | C1COC(O1)(CCl)C2=CC=C(C=C2)NCC3=C(C(=NC(=N3)N)N)C4=CC=C(C=C4)Cl |
| InChIKey | HOCRCWAAVSEDJQ-UHFFFAOYSA-N |
Product Overview
6-[[4-[2-(chloromethyl)-1,3-dioxolan-2-yl]anilino]methyl]-5- (CAS 18861-36-4), with molecular formula C21H21Cl2N5O2 and molecular weight 445.11 g/mol. IUPAC: 6-[[4-[2-(chloromethyl)-1,3-dioxolan-2-yl]anilino]methyl]-5-(4-chlorophenyl)pyrimidine-2,4-diamine.
Chemical Property Profile of 6-[[4-[2-(chloromethyl)-1,3-dioxolan-2-yl]anilino]methyl]-5-
Property Insights of 6-[[4-[2-(chloromethyl)-1,3-dioxolan-2-yl]anilino]methyl]-5-
The XLogP value of 3.1 indicates that 6-[[4-[2-(chloromethyl)-1,3-dioxolan-2-yl]anilino]methyl]-5- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 108.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-[[4-[2-(chloromethyl)-1,3-dioxolan-2-yl]anilino]methyl]-5-. Following Lipinski's Rule of Five, 6-[[4-[2-(chloromethyl)-1,3-dioxolan-2-yl]anilino]methyl]-5- has 3 hydrogen bond donor(s) and 7 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 6-[[4-[2-(chloromethyl)-1,3-dioxolan-2-yl]anilino]methyl]-5-?
The CAS number of 6-[[4-[2-(chloromethyl)-1,3-dioxolan-2-yl]anilino]methyl]-5- is 18861-36-4.
What is the molecular formula of 6-[[4-[2-(chloromethyl)-1,3-dioxolan-2-yl]anilino]methyl]-5-?
The molecular formula of 6-[[4-[2-(chloromethyl)-1,3-dioxolan-2-yl]anilino]methyl]-5- is C21H21Cl2N5O2.
What is the molecular weight of 6-[[4-[2-(chloromethyl)-1,3-dioxolan-2-yl]anilino]methyl]-5-?
The molecular weight of 6-[[4-[2-(chloromethyl)-1,3-dioxolan-2-yl]anilino]methyl]-5- is 445.11 g/mol.
Where can I buy 6-[[4-[2-(chloromethyl)-1,3-dioxolan-2-yl]anilino]methyl]-5-?
You can request a quote for 6-[[4-[2-(chloromethyl)-1,3-dioxolan-2-yl]anilino]methyl]-5- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-[[4-[2-(chloromethyl)-1,3-dioxolan-2-yl]anilino]methyl]-5-?
Yes, KEHONG BIO provides custom synthesis services for 6-[[4-[2-(chloromethyl)-1,3-dioxolan-2-yl]anilino]methyl]-5- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.