![ethyl N-[6-amino-4-[[3-(4-chloro-N-methylanilino)-2-hydroxypropyl]amino]-5-nitropyridin-2-yl]carbamate structure](/static/products/825/82585-87-3.png)
ethyl N-[6-amino-4-[[3-(4-chloro-N-methylanilino)-2-hydroxypropyl]amino]-5-nitropyridin-2-yl]carbamate
TL;DR: ethyl N-[6-amino-4-[[3-(4-chloro-N-methylanilino)-2-hydroxypropyl]amino]-5-nitropyridin-2-yl]carbamate (CAS 82585-87-3) is a chemical compound with molecular formula C18H23ClN6O5 and molecular weight 438.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl N-[6-amino-4-[[3-(4-chloro-N-methylanilino)-2-hydroxypropyl]amino]-5-nitro-2-pyridinyl]carbamate
Also Known As: ethyl N-[6-amino-4-[[3-(4-chloro-N-methylanilino)-2-hydroxypropyl]amino]-5-nitropyridin-2-yl]carbamate, ethyl N-[6-amino-4-[[3-(4-chloro-N-methylanilino)-2-hydroxyp, 6-Pyridinecarbamic acid,2-amino-4-[2-hydroxy-3-(N-methyl- 4-chloroanilino)propylamino]-3-nitro-, ethyl ester, Ethyl [6-amino-4-({3-[(4-chlorophenyl)(methyl)amino]-2-hydroxypropyl}amino)-5-nitropyridin-2-yl]carbamate, ethyl N-[6-amino-4-[[3-(4-chloro-N-methyl-anilino)-2-hydroxy-propyl]amino]-5-nitro-2-pyridyl]carbamate
| Molecular Formula | C18H23ClN6O5 |
|---|---|
| Molecular Weight | 438.14 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 159.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 9 |
| Exact Mass | 438.14185 |
| Heavy Atoms | 30 |
| Complexity | 560.0 |
Chemical Identifiers
| CAS Number | 82585-87-3 |
|---|---|
| SMILES | CCOC(=O)NC1=NC(=C(C(=C1)NCC(CN(C)C2=CC=C(C=C2)Cl)O)[N+](=O)[O-])N |
| InChIKey | YFVYUIMWMCYORO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
ethyl N-[6-amino-4-[[3-(4-chloro-N-methylanilino)-2-hydroxypropyl]amino]-5-nitropyridin-2-yl]carbamate (CAS 82585-87-3), with molecular formula C18H23ClN6O5 and molecular weight 438.14 g/mol. IUPAC: ethyl N-[6-amino-4-[[3-(4-chloro-N-methylanilino)-2-hydroxypropyl]amino]-5-nitro-2-pyridinyl]carbamate.
Chemical Property Profile of ethyl N-[6-amino-4-[[3-(4-chloro-N-methylanilino)-2-hydroxypropyl]amino]-5-nitropyridin-2-yl]carbamate
Property Insights of ethyl N-[6-amino-4-[[3-(4-chloro-N-methylanilino)-2-hydroxypropyl]amino]-5-nitropyridin-2-yl]carbamate
The XLogP value of 3.5 indicates that ethyl N-[6-amino-4-[[3-(4-chloro-N-methylanilino)-2-hydroxypropyl]amino]-5-nitropyridin-2-yl]carbamate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 159.0 Ų indicates high polarity, suggesting ethyl N-[6-amino-4-[[3-(4-chloro-N-methylanilino)-2-hydroxypropyl]amino]-5-nitropyridin-2-yl]carbamate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, ethyl N-[6-amino-4-[[3-(4-chloro-N-methylanilino)-2-hydroxypropyl]amino]-5-nitropyridin-2-yl]carbamate has 4 hydrogen bond donor(s) and 9 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 ethyl N-[6-amino-4-[[3-(4-chloro-N-methylanilino)-2-hydroxypropyl]amino]-5-nitropyridin-2-yl]carbamate?
The CAS number of ethyl N-[6-amino-4-[[3-(4-chloro-N-methylanilino)-2-hydroxypropyl]amino]-5-nitropyridin-2-yl]carbamate is 82585-87-3.
What is the molecular formula of ethyl N-[6-amino-4-[[3-(4-chloro-N-methylanilino)-2-hydroxypropyl]amino]-5-nitropyridin-2-yl]carbamate?
The molecular formula of ethyl N-[6-amino-4-[[3-(4-chloro-N-methylanilino)-2-hydroxypropyl]amino]-5-nitropyridin-2-yl]carbamate is C18H23ClN6O5.
What is the molecular weight of ethyl N-[6-amino-4-[[3-(4-chloro-N-methylanilino)-2-hydroxypropyl]amino]-5-nitropyridin-2-yl]carbamate?
The molecular weight of ethyl N-[6-amino-4-[[3-(4-chloro-N-methylanilino)-2-hydroxypropyl]amino]-5-nitropyridin-2-yl]carbamate is 438.14 g/mol.
Where can I buy ethyl N-[6-amino-4-[[3-(4-chloro-N-methylanilino)-2-hydroxypropyl]amino]-5-nitropyridin-2-yl]carbamate?
You can request a quote for ethyl N-[6-amino-4-[[3-(4-chloro-N-methylanilino)-2-hydroxypropyl]amino]-5-nitropyridin-2-yl]carbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethyl N-[6-amino-4-[[3-(4-chloro-N-methylanilino)-2-hydroxypropyl]amino]-5-nitropyridin-2-yl]carbamate?
Yes, KEHONG BIO provides custom synthesis services for ethyl N-[6-amino-4-[[3-(4-chloro-N-methylanilino)-2-hydroxypropyl]amino]-5-nitropyridin-2-yl]carbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.