ethyl N-[6-amino-4-[[2-hydroxyimino-2-[4-(trifluoromethyl)ph
TL;DR: ethyl N-[6-amino-4-[[2-hydroxyimino-2-[4-(trifluoromethyl)ph (CAS 82585-71-5) is a chemical compound with molecular formula C17H17F3N6O5 and molecular weight 442.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl N-[6-amino-4-[[2-hydroxyimino-2-[4-(trifluoromethyl)phenyl]ethyl]amino]-5-nitro-2-pyridinyl]carbamate
Also Known As: ethyl N-[6-amino-4-[[2-hydroxyimino-2-[4-(trifluoromethyl)ph, Ethyl [6-amino-4-({2-(hydroxyimino)-2-[4-(trifluoromethyl)phenyl]ethyl}amino)-5-nitropyridin-2-yl]carbamate, ethyl N-[6-amino-4-[[2-hydroxyimino-2-[4-(trifluoromethyl)phenyl]ethyl]amino]-5-nitropyridin-2-yl]carbamate, ETHYL N-[6-AMINO-4-[[(2Z)-2-HYDROXYIMINO-2-[4-(TRIFLUOROMETHYL)PHENYL]ETHYL]AMINO]-5-NITRO-(PYRIDIN-2-YL)]CARBAMATE, Ethyl n-[6-amino-4-[[(2z)-2-hydroxyimino-2-[4-(trifluoromethyl)phenyl]ethyl]amino]-5-nitro-pyridin-2-yl]carbamate
| Molecular Formula | C17H17F3N6O5 |
|---|---|
| Molecular Weight | 442.12 g/mol |
| LogP | 4.3 |
| Topological Polar Surface Area | 168.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 7 |
| Exact Mass | 442.12125 |
| Heavy Atoms | 31 |
| Complexity | 651.0 |
Chemical Identifiers
| CAS Number | 82585-71-5 |
|---|---|
| SMILES | CCOC(=O)NC1=NC(=C(C(=C1)NCC(=NO)C2=CC=C(C=C2)C(F)(F)F)[N+](=O)[O-])N |
| InChIKey | YIVVRTMODHSFFX-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-[[2-hydroxyimino-2-[4-(trifluoromethyl)ph (CAS 82585-71-5), with molecular formula C17H17F3N6O5 and molecular weight 442.12 g/mol. IUPAC: ethyl N-[6-amino-4-[[2-hydroxyimino-2-[4-(trifluoromethyl)phenyl]ethyl]amino]-5-nitro-2-pyridinyl]carbamate.
Chemical Property Profile of ethyl N-[6-amino-4-[[2-hydroxyimino-2-[4-(trifluoromethyl)ph
Property Insights of ethyl N-[6-amino-4-[[2-hydroxyimino-2-[4-(trifluoromethyl)ph
The XLogP value of 4.3 indicates that ethyl N-[6-amino-4-[[2-hydroxyimino-2-[4-(trifluoromethyl)ph is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 168.0 Ų indicates high polarity, suggesting ethyl N-[6-amino-4-[[2-hydroxyimino-2-[4-(trifluoromethyl)ph may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, ethyl N-[6-amino-4-[[2-hydroxyimino-2-[4-(trifluoromethyl)ph has 4 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of ethyl N-[6-amino-4-[[2-hydroxyimino-2-[4-(trifluoromethyl)ph?
The CAS number of ethyl N-[6-amino-4-[[2-hydroxyimino-2-[4-(trifluoromethyl)ph is 82585-71-5.
What is the molecular formula of ethyl N-[6-amino-4-[[2-hydroxyimino-2-[4-(trifluoromethyl)ph?
The molecular formula of ethyl N-[6-amino-4-[[2-hydroxyimino-2-[4-(trifluoromethyl)ph is C17H17F3N6O5.
What is the molecular weight of ethyl N-[6-amino-4-[[2-hydroxyimino-2-[4-(trifluoromethyl)ph?
The molecular weight of ethyl N-[6-amino-4-[[2-hydroxyimino-2-[4-(trifluoromethyl)ph is 442.12 g/mol.
Where can I buy ethyl N-[6-amino-4-[[2-hydroxyimino-2-[4-(trifluoromethyl)ph?
You can request a quote for ethyl N-[6-amino-4-[[2-hydroxyimino-2-[4-(trifluoromethyl)ph 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-[[2-hydroxyimino-2-[4-(trifluoromethyl)ph?
Yes, KEHONG BIO provides custom synthesis services for ethyl N-[6-amino-4-[[2-hydroxyimino-2-[4-(trifluoromethyl)ph and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.