![5-(3,4-Dichlorophenyl)-6-[(3-methyl-4-nitrophenoxy)methyl]pyrimidine-2,4-diamine structure](/static/products/2197/21975-82-6.webp)
5-(3,4-Dichlorophenyl)-6-[(3-methyl-4-nitrophenoxy)methyl]pyrimidine-2,4-diamine
TL;DR: 5-(3,4-Dichlorophenyl)-6-[(3-methyl-4-nitrophenoxy)methyl]pyrimidine-2,4-diamine (CAS 21975-82-6) is a chemical compound with molecular formula C18H15Cl2N5O3 and molecular weight 419.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(3,4-dichlorophenyl)-6-[(3-methyl-4-nitrophenoxy)methyl]pyrimidine-2,4-diamine
Also Known As: NCIStruc1_001349, NCIStruc2_001691, 5-(3,4-dichlorophenyl)-6-[(3-methyl-4-nitrophenoxy)methyl]py, 2,4-Pyrimidinediamine, 5-(3,4-dichlorophenyl)-6-[(3-methyl-4-nitrophenoxy)methyl]-, 5-(3,4-dichlorophenyl)-6-[(3-methyl-4-nitrophenoxy)methyl]pyrimidine-2,4-diamine
| Molecular Formula | C18H15Cl2N5O3 |
|---|---|
| Molecular Weight | 419.06 g/mol |
| LogP | 4.1 |
| Topological Polar Surface Area | 133.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 419.0552 |
| Heavy Atoms | 28 |
| Complexity | 540.0 |
Chemical Identifiers
| CAS Number | 21975-82-6 |
|---|---|
| SMILES | CC1=C(C=CC(=C1)OCC2=C(C(=NC(=N2)N)N)C3=CC(=C(C=C3)Cl)Cl)[N+](=O)[O-] |
| InChIKey | WEDPZHMFZWFEPC-UHFFFAOYSA-N |
Product Overview
5-(3,4-Dichlorophenyl)-6-[(3-methyl-4-nitrophenoxy)methyl]pyrimidine-2,4-diamine (CAS 21975-82-6), with molecular formula C18H15Cl2N5O3 and molecular weight 419.06 g/mol. IUPAC: 5-(3,4-dichlorophenyl)-6-[(3-methyl-4-nitrophenoxy)methyl]pyrimidine-2,4-diamine.
Chemical Property Profile of 5-(3,4-Dichlorophenyl)-6-[(3-methyl-4-nitrophenoxy)methyl]pyrimidine-2,4-diamine
Property Insights of 5-(3,4-Dichlorophenyl)-6-[(3-methyl-4-nitrophenoxy)methyl]pyrimidine-2,4-diamine
The XLogP value of 4.1 indicates that 5-(3,4-Dichlorophenyl)-6-[(3-methyl-4-nitrophenoxy)methyl]pyrimidine-2,4-diamine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 133.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-(3,4-Dichlorophenyl)-6-[(3-methyl-4-nitrophenoxy)methyl]pyrimidine-2,4-diamine. Following Lipinski's Rule of Five, 5-(3,4-Dichlorophenyl)-6-[(3-methyl-4-nitrophenoxy)methyl]pyrimidine-2,4-diamine has 2 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 5-(3,4-Dichlorophenyl)-6-[(3-methyl-4-nitrophenoxy)methyl]pyrimidine-2,4-diamine?
The CAS number of 5-(3,4-Dichlorophenyl)-6-[(3-methyl-4-nitrophenoxy)methyl]pyrimidine-2,4-diamine is 21975-82-6.
What is the molecular formula of 5-(3,4-Dichlorophenyl)-6-[(3-methyl-4-nitrophenoxy)methyl]pyrimidine-2,4-diamine?
The molecular formula of 5-(3,4-Dichlorophenyl)-6-[(3-methyl-4-nitrophenoxy)methyl]pyrimidine-2,4-diamine is C18H15Cl2N5O3.
What is the molecular weight of 5-(3,4-Dichlorophenyl)-6-[(3-methyl-4-nitrophenoxy)methyl]pyrimidine-2,4-diamine?
The molecular weight of 5-(3,4-Dichlorophenyl)-6-[(3-methyl-4-nitrophenoxy)methyl]pyrimidine-2,4-diamine is 419.06 g/mol.
Where can I buy 5-(3,4-Dichlorophenyl)-6-[(3-methyl-4-nitrophenoxy)methyl]pyrimidine-2,4-diamine?
You can request a quote for 5-(3,4-Dichlorophenyl)-6-[(3-methyl-4-nitrophenoxy)methyl]pyrimidine-2,4-diamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(3,4-Dichlorophenyl)-6-[(3-methyl-4-nitrophenoxy)methyl]pyrimidine-2,4-diamine?
Yes, KEHONG BIO provides custom synthesis services for 5-(3,4-Dichlorophenyl)-6-[(3-methyl-4-nitrophenoxy)methyl]pyrimidine-2,4-diamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.