4,6-Bis(2,5-dimethylanilino)-5-nitropyrimidine
TL;DR: 4,6-Bis(2,5-dimethylanilino)-5-nitropyrimidine (CAS 300398-77-0) is a chemical compound with molecular formula C20H21N5O2 and molecular weight 363.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-N,6-N-bis(2,5-dimethylphenyl)-5-nitropyrimidine-4,6-diamine
Also Known As: 4,6-bis(2,5-dimethylanilino)-5-nitropyrimidine, BAS 00071820, 4-N,6-N-bis(2,5-dimethylphenyl)-5-nitropyrimidine-4,6-diamine, N,N'-Bis-(2,5-dimethyl-phenyl)-5-nitro-pyrimidine-4,6-diamine
| Molecular Formula | C20H21N5O2 |
|---|---|
| Molecular Weight | 363.17 g/mol |
| LogP | 5.10568 |
| Topological Polar Surface Area | 92.98 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 363.16953 |
| Heavy Atoms | 27 |
| Complexity | 945.4991 |
Chemical Identifiers
| CAS Number | 300398-77-0 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)C)NC2=C(C(=NC=N2)NC3=C(C=CC(=C3)C)C)[N+](=O)[O-] |
Product Overview
4,6-Bis(2,5-dimethylanilino)-5-nitropyrimidine (CAS 300398-77-0), with molecular formula C20H21N5O2 and molecular weight 363.17 g/mol. IUPAC: 4-N,6-N-bis(2,5-dimethylphenyl)-5-nitropyrimidine-4,6-diamine.
Chemical Property Profile of 4,6-Bis(2,5-dimethylanilino)-5-nitropyrimidine
Property Insights of 4,6-Bis(2,5-dimethylanilino)-5-nitropyrimidine
The XLogP value of 5.10568 indicates that 4,6-Bis(2,5-dimethylanilino)-5-nitropyrimidine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 92.98 Ų falls within the moderate polarity range, balancing permeability and solubility for 4,6-Bis(2,5-dimethylanilino)-5-nitropyrimidine. Following Lipinski's Rule of Five, 4,6-Bis(2,5-dimethylanilino)-5-nitropyrimidine has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4,6-Bis(2,5-dimethylanilino)-5-nitropyrimidine?
The CAS number of 4,6-Bis(2,5-dimethylanilino)-5-nitropyrimidine is 300398-77-0.
What is the molecular formula of 4,6-Bis(2,5-dimethylanilino)-5-nitropyrimidine?
The molecular formula of 4,6-Bis(2,5-dimethylanilino)-5-nitropyrimidine is C20H21N5O2.
What is the molecular weight of 4,6-Bis(2,5-dimethylanilino)-5-nitropyrimidine?
The molecular weight of 4,6-Bis(2,5-dimethylanilino)-5-nitropyrimidine is 363.17 g/mol.
Where can I buy 4,6-Bis(2,5-dimethylanilino)-5-nitropyrimidine?
You can request a quote for 4,6-Bis(2,5-dimethylanilino)-5-nitropyrimidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,6-Bis(2,5-dimethylanilino)-5-nitropyrimidine?
Yes, KEHONG BIO provides custom synthesis services for 4,6-Bis(2,5-dimethylanilino)-5-nitropyrimidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.