2-amino-1-(2-methoxyethyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carbonitrile - CAS 683781-30-8
Catalog: |
BB033541 |
Product Name: |
2-amino-1-(2-methoxyethyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carbonitrile |
CAS: |
683781-30-8 |
Synonyms: |
2-amino-1-(2-methoxyethyl)-3-pyrrolo[3,2-b]quinoxalinecarbonitrile; 2-amino-1-(2-methoxyethyl)pyrrolo[3,2-b]quinoxaline-3-carbonitrile |
IUPAC Name: | 2-amino-1-(2-methoxyethyl)pyrrolo[3,2-b]quinoxaline-3-carbonitrile |
Description: | 2-amino-1-(2-methoxyethyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carbonitrile (CAS# 683781-30-8) is a useful research chemical. |
Molecular Weight: | 267.292 |
Molecular Formula: | C14H13N5O |
Canonical SMILES: | COCCN1C(=C(C2=NC3=CC=CC=C3N=C21)C#N)N |
InChI: | InChI=1S/C14H13N5O/c1-20-7-6-19-13(16)9(8-15)12-14(19)18-11-5-3-2-4-10(11)17-12/h2-5H,6-7,16H2,1H3 |
InChI Key: | SRKNPOBWGCUDTA-UHFFFAOYSA-N |
Complexity: | 394 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 267.11201006 |
Formal Charge: | 0 |
Heavy Atom Count: | 20 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 267.11201006 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 89.8 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.1 |
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