4-N,6-N-bis(furan-2-ylmethyl)-5-nitropyrimidine-4,6-diamine
TL;DR: 4-N,6-N-bis(furan-2-ylmethyl)-5-nitropyrimidine-4,6-diamine (CAS 21120-91-2) is a chemical compound with molecular formula C14H13N5O4 and molecular weight 315.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-N,6-N-bis(furan-2-ylmethyl)-5-nitropyrimidine-4,6-diamine
Also Known As: NCIOpen2_008907, 4-N,6-N-bis(furan-2-ylmethyl)-5-nitropyrimidine-4,6-diamine, n,n'-bis(2-furylmethyl)-5-nitropyrimidine-4,6-diamine, 4,6-Pyrimidinediamine,n4,n6-bis(2-furanylmethyl)-5-nitro-, N~4~,N~6~-Bis[(furan-2-yl)methyl]-5-nitropyrimidine-4,6-diamine
| Molecular Formula | C14H13N5O4 |
|---|---|
| Molecular Weight | 315.10 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 122.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 315.09674 |
| Heavy Atoms | 23 |
| Complexity | 366.0 |
Chemical Identifiers
| CAS Number | 21120-91-2 |
|---|---|
| SMILES | C1=COC(=C1)CNC2=C(C(=NC=N2)NCC3=CC=CO3)[N+](=O)[O-] |
| InChIKey | YAKCXRCZVYGCIP-UHFFFAOYSA-N |
Product Overview
4-N,6-N-bis(furan-2-ylmethyl)-5-nitropyrimidine-4,6-diamine (CAS 21120-91-2), with molecular formula C14H13N5O4 and molecular weight 315.10 g/mol. IUPAC: 4-N,6-N-bis(furan-2-ylmethyl)-5-nitropyrimidine-4,6-diamine.
Chemical Property Profile of 4-N,6-N-bis(furan-2-ylmethyl)-5-nitropyrimidine-4,6-diamine
Property Insights of 4-N,6-N-bis(furan-2-ylmethyl)-5-nitropyrimidine-4,6-diamine
The XLogP value of 3.0 indicates that 4-N,6-N-bis(furan-2-ylmethyl)-5-nitropyrimidine-4,6-diamine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 122.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-N,6-N-bis(furan-2-ylmethyl)-5-nitropyrimidine-4,6-diamine. Following Lipinski's Rule of Five, 4-N,6-N-bis(furan-2-ylmethyl)-5-nitropyrimidine-4,6-diamine has 2 hydrogen bond donor(s) and 8 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 4-N,6-N-bis(furan-2-ylmethyl)-5-nitropyrimidine-4,6-diamine?
The CAS number of 4-N,6-N-bis(furan-2-ylmethyl)-5-nitropyrimidine-4,6-diamine is 21120-91-2.
What is the molecular formula of 4-N,6-N-bis(furan-2-ylmethyl)-5-nitropyrimidine-4,6-diamine?
The molecular formula of 4-N,6-N-bis(furan-2-ylmethyl)-5-nitropyrimidine-4,6-diamine is C14H13N5O4.
What is the molecular weight of 4-N,6-N-bis(furan-2-ylmethyl)-5-nitropyrimidine-4,6-diamine?
The molecular weight of 4-N,6-N-bis(furan-2-ylmethyl)-5-nitropyrimidine-4,6-diamine is 315.10 g/mol.
Where can I buy 4-N,6-N-bis(furan-2-ylmethyl)-5-nitropyrimidine-4,6-diamine?
You can request a quote for 4-N,6-N-bis(furan-2-ylmethyl)-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 4-N,6-N-bis(furan-2-ylmethyl)-5-nitropyrimidine-4,6-diamine?
Yes, KEHONG BIO provides custom synthesis services for 4-N,6-N-bis(furan-2-ylmethyl)-5-nitropyrimidine-4,6-diamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.