4-(4-Ethyl-1-piperazinyl)-2-nitroaniline - CAS 1702260-52-3
Catalog: |
BB012626 |
Product Name: |
4-(4-Ethyl-1-piperazinyl)-2-nitroaniline |
CAS: |
1702260-52-3 |
Synonyms: |
4-(4-ethyl-1-piperazinyl)-2-nitroaniline; 4-(4-ethylpiperazin-1-yl)-2-nitroaniline |
IUPAC Name: | 4-(4-ethylpiperazin-1-yl)-2-nitroaniline |
Description: | 4-(4-Ethyl-1-piperazinyl)-2-nitroaniline (CAS# 1702260-52-3 ) is a useful research chemical. |
Molecular Weight: | 250.30 |
Molecular Formula: | C12H18N4O2 |
Canonical SMILES: | CCN1CCN(CC1)C2=CC(=C(C=C2)N)[N+](=O)[O-] |
InChI: | InChI=1S/C12H18N4O2/c1-2-14-5-7-15(8-6-14)10-3-4-11(13)12(9-10)16(17)18/h3-4,9H,2,5-8,13H2,1H3 |
InChI Key: | HTZZDIGHKJVORN-UHFFFAOYSA-N |
LogP: | 2.42620 |
Publication Number | Title | Priority Date |
WO-2020119606-A1 | Heterocyclic compounds as inhibitors of fibroblast growth factor receptor | 20181210 |
CN-110857300-A | Condensed ring triazole compounds, preparation method and application | 20180823 |
WO-2020038458-A1 | Class of fused ring triazole compound, preparation method, and use | 20180823 |
WO-2019085894-A1 | Nitrogen-containing fused ring compound, preparation method therefor, and use thereof | 20171030 |
CN-109721600-B | Nitrogen-containing fused ring compounds and preparation method and application thereof | 20171030 |
Complexity: | 286 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 250.14297583 |
Formal Charge: | 0 |
Heavy Atom Count: | 18 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 250.14297583 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 78.3 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.5 |
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