N,N-二甲基-5-硝基-1H-吲唑-1-乙胺
TL;DR: N,N-二甲基-5-硝基-1H-吲唑-1-乙胺 (CAS 36173-99-6) is a chemical compound with molecular formula C11H14N4O2 and molecular weight 234.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,N-二甲基-5-硝基-1H-吲唑-1-乙胺
N,N-dimethyl-2-(5-nitroindazol-1-yl)ethanamine
Also Known As: N,N-dimethyl-2-(5-nitroindazol-1-yl)ethanamine, 1H-Indazole-1-ethanamine, N,N-dimethyl-5-nitro-, dimethyl-[2-(5-nitro-indazol-1-yl)-ethyl]-amine, N,N-Dimethyl-2-(5-nitro-1H-indazol-1-yl)ethan-1-amine
| Molecular Formula | C11H14N4O2 |
|---|---|
| Molecular Weight | 234.11 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 66.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 234.11168 |
| Heavy Atoms | 17 |
| Complexity | 279.0 |
Chemical Identifiers
| CAS Number | 36173-99-6 |
|---|---|
| SMILES | CN(C)CCN1C2=C(C=C(C=C2)[N+](=O)[O-])C=N1 |
| InChIKey | BHCKWNCABQSFOK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N,N-二甲基-5-硝基-1H-吲唑-1-乙胺 (CAS 36173-99-6), with molecular formula C11H14N4O2 and molecular weight 234.11 g/mol. IUPAC: N,N-dimethyl-2-(5-nitroindazol-1-yl)ethanamine.
Chemical Property Profile of N,N-二甲基-5-硝基-1H-吲唑-1-乙胺
Property Insights of N,N-二甲基-5-硝基-1H-吲唑-1-乙胺
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N,N-二甲基-5-硝基-1H-吲唑-1-乙胺. The TPSA of 66.9 Ų falls within the moderate polarity range, balancing permeability and solubility for N,N-二甲基-5-硝基-1H-吲唑-1-乙胺. Following Lipinski's Rule of Five, N,N-二甲基-5-硝基-1H-吲唑-1-乙胺 has 0 hydrogen bond donor(s) and 4 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 N,N-二甲基-5-硝基-1H-吲唑-1-乙胺?
The CAS number of N,N-二甲基-5-硝基-1H-吲唑-1-乙胺 is 36173-99-6.
What is the molecular formula of N,N-二甲基-5-硝基-1H-吲唑-1-乙胺?
The molecular formula of N,N-二甲基-5-硝基-1H-吲唑-1-乙胺 is C11H14N4O2.
What is the molecular weight of N,N-二甲基-5-硝基-1H-吲唑-1-乙胺?
The molecular weight of N,N-二甲基-5-硝基-1H-吲唑-1-乙胺 is 234.11 g/mol.
Where can I buy N,N-二甲基-5-硝基-1H-吲唑-1-乙胺?
You can request a quote for N,N-二甲基-5-硝基-1H-吲唑-1-乙胺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N,N-二甲基-5-硝基-1H-吲唑-1-乙胺?
Yes, KEHONG BIO provides custom synthesis services for N,N-二甲基-5-硝基-1H-吲唑-1-乙胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.