N4-(naphthalen-1-yl)-5-nitropyrimidine-4,6-diamine
TL;DR: N4-(naphthalen-1-yl)-5-nitropyrimidine-4,6-diamine (CAS 127820-28-4) is a chemical compound with molecular formula C14H11N5O2 and molecular weight 281.09128 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-N-naphthalen-1-yl-5-nitropyrimidine-4,6-diamine
Also Known As: N4-(naphthalen-1-yl)-5-nitropyrimidine-4,6-diamine, BAS 00253881, 4-N-naphthalen-1-yl-5-nitropyrimidine-4,6-diamine, 6-amino-4-(1-naphthylamino)-5-nitropyrimidine, N-(naphthalen-1-yl)-5-nitropyrimidine-4,6-diamine
Technical Specifications
| Molecular Formula | C14H11N5O2 |
| Molecular Weight | 281.09128 g/mol |
| XLogP | 3.9 |
| Topological Polar Surface Area (TPSA) | 110.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 281.09128 Da |
| Heavy Atoms | 21 |
| Complexity | 375.0 |
| SMILES | C1=CC=C2C(=C1)C=CC=C2NC3=NC=NC(=C3[N+](=O)[O-])N |
| InChIKey | XOQHGSDVNFQVGG-UHFFFAOYSA-N |
Chemical Property Profile of N4-(naphthalen-1-yl)-5-nitropyrimidine-4,6-diamine
Property Insights of N4-(naphthalen-1-yl)-5-nitropyrimidine-4,6-diamine
The XLogP value of 3.9 indicates that N4-(naphthalen-1-yl)-5-nitropyrimidine-4,6-diamine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 110.0 Ų falls within the moderate polarity range, balancing permeability and solubility for N4-(naphthalen-1-yl)-5-nitropyrimidine-4,6-diamine. Following Lipinski's Rule of Five, N4-(naphthalen-1-yl)-5-nitropyrimidine-4,6-diamine has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of N4-(naphthalen-1-yl)-5-nitropyrimidine-4,6-diamine?
The CAS number of N4-(naphthalen-1-yl)-5-nitropyrimidine-4,6-diamine is 127820-28-4.
What is the molecular formula of N4-(naphthalen-1-yl)-5-nitropyrimidine-4,6-diamine?
The molecular formula of N4-(naphthalen-1-yl)-5-nitropyrimidine-4,6-diamine is C14H11N5O2.
What is the molecular weight of N4-(naphthalen-1-yl)-5-nitropyrimidine-4,6-diamine?
The molecular weight of N4-(naphthalen-1-yl)-5-nitropyrimidine-4,6-diamine is 281.09128 g/mol.
Where can I buy N4-(naphthalen-1-yl)-5-nitropyrimidine-4,6-diamine?
You can request a quote for N4-(naphthalen-1-yl)-5-nitropyrimidine-4,6-diamine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for N4-(naphthalen-1-yl)-5-nitropyrimidine-4,6-diamine?
Yes, CoreyChem provides custom synthesis services for N4-(naphthalen-1-yl)-5-nitropyrimidine-4,6-diamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.