N,N'-bis(4-butoxybenzyl)-5-nitropyrimidine-4,6-diamine
TL;DR: N,N'-bis(4-butoxybenzyl)-5-nitropyrimidine-4,6-diamine (CAS 325957-69-5) is a chemical compound with molecular formula C26H33N5O4 and molecular weight 479.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-N,6-N-bis[(4-butoxyphenyl)methyl]-5-nitropyrimidine-4,6-diamine
Also Known As: N,N'-bis(4-butoxybenzyl)-5-nitropyrimidine-4,6-diamine, N4,N6-bis(4-butoxybenzyl)-5-nitropyrimidine-4,6-diamine, 4-N,6-N-bis[(4-butoxyphenyl)methyl]-5-nitropyrimidine-4,6-diamine, N,N'-bis[(4-butoxyphenyl)methyl]-5-nitro-pyrimidine-4,6-diamine, N4,N6-BIS[(4-BUTOXYPHENYL)METHYL]-5-NITROPYRIMIDINE-4,6-DIAMINE
| Molecular Formula | C26H33N5O4 |
|---|---|
| Molecular Weight | 479.25 g/mol |
| LogP | 5.9668 |
| Topological Polar Surface Area | 111.44 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 15 |
| Exact Mass | 479.25327 |
| Heavy Atoms | 35 |
| Complexity | 982.5922 |
Chemical Identifiers
| CAS Number | 325957-69-5 |
|---|---|
| SMILES | CCCCOC1=CC=C(C=C1)CNC2=C(C(=NC=N2)NCC3=CC=C(C=C3)OCCCC)[N+](=O)[O-] |
Product Overview
N,N'-bis(4-butoxybenzyl)-5-nitropyrimidine-4,6-diamine (CAS 325957-69-5), with molecular formula C26H33N5O4 and molecular weight 479.25 g/mol. IUPAC: 4-N,6-N-bis[(4-butoxyphenyl)methyl]-5-nitropyrimidine-4,6-diamine.
Chemical Property Profile of N,N'-bis(4-butoxybenzyl)-5-nitropyrimidine-4,6-diamine
Property Insights of N,N'-bis(4-butoxybenzyl)-5-nitropyrimidine-4,6-diamine
The XLogP value of 5.9668 indicates that N,N'-bis(4-butoxybenzyl)-5-nitropyrimidine-4,6-diamine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 111.44 Ų falls within the moderate polarity range, balancing permeability and solubility for N,N'-bis(4-butoxybenzyl)-5-nitropyrimidine-4,6-diamine. Following Lipinski's Rule of Five, N,N'-bis(4-butoxybenzyl)-5-nitropyrimidine-4,6-diamine has 2 hydrogen bond donor(s) and 8 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(4-butoxybenzyl)-5-nitropyrimidine-4,6-diamine?
The CAS number of N,N'-bis(4-butoxybenzyl)-5-nitropyrimidine-4,6-diamine is 325957-69-5.
What is the molecular formula of N,N'-bis(4-butoxybenzyl)-5-nitropyrimidine-4,6-diamine?
The molecular formula of N,N'-bis(4-butoxybenzyl)-5-nitropyrimidine-4,6-diamine is C26H33N5O4.
What is the molecular weight of N,N'-bis(4-butoxybenzyl)-5-nitropyrimidine-4,6-diamine?
The molecular weight of N,N'-bis(4-butoxybenzyl)-5-nitropyrimidine-4,6-diamine is 479.25 g/mol.
Where can I buy N,N'-bis(4-butoxybenzyl)-5-nitropyrimidine-4,6-diamine?
You can request a quote for N,N'-bis(4-butoxybenzyl)-5-nitropyrimidine-4,6-diamine 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(4-butoxybenzyl)-5-nitropyrimidine-4,6-diamine?
Yes, KEHONG BIO provides custom synthesis services for N,N'-bis(4-butoxybenzyl)-5-nitropyrimidine-4,6-diamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.