Carbamic acid, (4,6-diamino-5-nitro-2-pyridinyl)-, ethyl ester
TL;DR: Carbamic acid, (4,6-diamino-5-nitro-2-pyridinyl)-, ethyl ester (CAS 6502-02-9) is a chemical compound with molecular formula C8H11N5O4 and molecular weight 241.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl N-(4,6-diamino-5-nitro-2-pyridinyl)carbamate
Also Known As: ethyl N-(4,6-diamino-5-nitropyridin-2-yl)carbamate, Ethyl (4,6-diamino-5-nitropyridin-2-yl)carbamate, Carbamic acid, (4,6-diamino-5-nitro-2-pyridinyl)-, ethyl ester, ethyl N-(4,6-diamino-5-nitro-2-pyridyl)carbamate, N-[4,6-Diamino-5-nitro-2-pyridinyl]carbamic acid ethyl ester
| Molecular Formula | C8H11N5O4 |
|---|---|
| Molecular Weight | 241.08 g/mol |
| LogP | 0.7226 |
| Topological Polar Surface Area | 146.4 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 241.0811 |
| Heavy Atoms | 17 |
| Complexity | 438.2239 |
Chemical Identifiers
| CAS Number | 6502-02-9 |
|---|---|
| SMILES | CCOC(=O)NC1=NC(=C(C(=C1)N)[N+](=O)[O-])N |
Product Overview
Carbamic acid, (4,6-diamino-5-nitro-2-pyridinyl)-, ethyl ester (CAS 6502-02-9), with molecular formula C8H11N5O4 and molecular weight 241.08 g/mol. IUPAC: ethyl N-(4,6-diamino-5-nitro-2-pyridinyl)carbamate.
Chemical Property Profile of Carbamic acid, (4,6-diamino-5-nitro-2-pyridinyl)-, ethyl ester
Property Insights of Carbamic acid, (4,6-diamino-5-nitro-2-pyridinyl)-, ethyl ester
The XLogP value of 0.7226 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Carbamic acid, (4,6-diamino-5-nitro-2-pyridinyl)-, ethyl ester. The TPSA of 146.4 Ų indicates high polarity, suggesting Carbamic acid, (4,6-diamino-5-nitro-2-pyridinyl)-, ethyl ester may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Carbamic acid, (4,6-diamino-5-nitro-2-pyridinyl)-, ethyl ester has 3 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 Carbamic acid, (4,6-diamino-5-nitro-2-pyridinyl)-, ethyl ester?
The CAS number of Carbamic acid, (4,6-diamino-5-nitro-2-pyridinyl)-, ethyl ester is 6502-02-9.
What is the molecular formula of Carbamic acid, (4,6-diamino-5-nitro-2-pyridinyl)-, ethyl ester?
The molecular formula of Carbamic acid, (4,6-diamino-5-nitro-2-pyridinyl)-, ethyl ester is C8H11N5O4.
What is the molecular weight of Carbamic acid, (4,6-diamino-5-nitro-2-pyridinyl)-, ethyl ester?
The molecular weight of Carbamic acid, (4,6-diamino-5-nitro-2-pyridinyl)-, ethyl ester is 241.08 g/mol.
Where can I buy Carbamic acid, (4,6-diamino-5-nitro-2-pyridinyl)-, ethyl ester?
You can request a quote for Carbamic acid, (4,6-diamino-5-nitro-2-pyridinyl)-, ethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Carbamic acid, (4,6-diamino-5-nitro-2-pyridinyl)-, ethyl ester?
Yes, KEHONG BIO provides custom synthesis services for Carbamic acid, (4,6-diamino-5-nitro-2-pyridinyl)-, ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.