triethoxy(tetrazolo[1,5-a]quinoxalin-4-ylimino)-λ5-phosphane

C14H19N6O3P — CID 4193241

IUPACtriethoxy(tetrazolo[1,5-a]quinoxalin-4-ylimino)-λ5-phosphane
SMILESCCOP(=Nc1nc2ccccc2n2nnnc12)(OCC)OCC
InChIInChI=1S/C14H19N6O3P/c1-4-21-24(22-5-2,23-6-3)17-13-14-16-18-19-20(14)12-10-8-7-9-11(12)15-13/h7-10H,4-6H2,1-3H3
InChIKeyXTXYKSFDWYIIQO-UHFFFAOYSA-N
MW350.32 g/mol
LogP3.36
Rot. Bonds7

About triethoxy(tetrazolo[1,5-a]quinoxalin-4-ylimino)-λ5-phosphane

triethoxy(tetrazolo[1,5-a]quinoxalin-4-ylimino)-λ5-phosphane (PubChem CID 4193241) has the molecular formula C14H19N6O3P and a molecular weight of 350.32 g/mol. Its IUPAC name is triethoxy(tetrazolo[1,5-a]quinoxalin-4-ylimino)-λ5-phosphane.

Molecular Properties

Compound Nametriethoxy(tetrazolo[1,5-a]quinoxalin-4-ylimino)-λ5-phosphane
PubChem CID4193241
Molecular FormulaC14H19N6O3P
Molecular Weight350.32 g/mol
Exact Mass350.13
IUPAC Nametriethoxy(tetrazolo[1,5-a]quinoxalin-4-ylimino)-λ5-phosphane
SMILESCCOP(=Nc1nc2ccccc2n2nnnc12)(OCC)OCC
InChIInChI=1S/C14H19N6O3P/c1-4-21-24(22-5-2,23-6-3)17-13-14-16-18-19-20(14)12-10-8-7-9-11(12)15-13/h7-10H,4-6H2,1-3H3
InChIKeyXTXYKSFDWYIIQO-UHFFFAOYSA-N
XLogP3.36
TPSA96.02 Ų
H-Bond Donors
H-Bond Acceptors9
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.32
LogP ≤ 53.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 109

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phosphor', 'substructure': 'N/A'}

Analyze triethoxy(tetrazolo[1,5-a]quinoxalin-4-ylimino)-λ5-phosphane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

ethyl 2-(tetrazolo[1,5-a]quinoxalin-4-ylsulfanyl)acetate
CID 22434313
ethyl 5-amino-1-(tetrazolo[1,5-a]quinoxalin-4-yl)pyrazole-4-carboxylate
CID 102024151
4-[(E)-2-(4-methoxyphenyl)ethenyl]tetrazolo[1,5-a]quinoxaline
CID 42598956
4-hydroxy-1-methyl-3-(tetrazolo[1,5-a]quinoxalin-4-yliminomethyl)quinolin-2-one
CID 135573832
5-ethoxytetrazolo[1,5-c]quinazoline
CID 45094403
2-(tetrazolo[1,5-a]quinoxalin-4-ylamino)phenol
CID 135458511
4-(3,6-ditert-butylcarbazol-9-yl)tetrazolo[1,5-a]quinoxaline
CID 172994583
4-(tetrazolo[1,5-a]quinoxalin-4-yl)morpholine
CID 5309141
4-[4-[3,6-di(carbazol-9-yl)carbazol-9-yl]phenyl]tetrazolo[1,5-a]quinoxaline
CID 172994580
N-(2-methylcyclohexyl)tetrazolo[1,5-a]quinoxalin-4-amine
CID 20889099
4-chloro-8-methyltetrazolo[1,5-a]quinoxaline
CID 4202676
10-methyl-2,3,4,5,8,9,11-heptazatetracyclo[10.4.0.02,6.07,11]hexadeca-1(16),3,5,7,9,12,14-heptaene
CID 12933159

Frequently Asked Questions

What is the IUPAC name of triethoxy(tetrazolo[1,5-a]quinoxalin-4-ylimino)-λ5-phosphane?
The IUPAC name of triethoxy(tetrazolo[1,5-a]quinoxalin-4-ylimino)-λ5-phosphane (CID 4193241) is triethoxy(tetrazolo[1,5-a]quinoxalin-4-ylimino)-λ5-phosphane.
What is the SMILES notation for triethoxy(tetrazolo[1,5-a]quinoxalin-4-ylimino)-λ5-phosphane?
The canonical SMILES for triethoxy(tetrazolo[1,5-a]quinoxalin-4-ylimino)-λ5-phosphane is CCOP(=Nc1nc2ccccc2n2nnnc12)(OCC)OCC.
What is the InChIKey of triethoxy(tetrazolo[1,5-a]quinoxalin-4-ylimino)-λ5-phosphane?
The InChIKey is XTXYKSFDWYIIQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N6O3P/c1-4-21-24(22-5-2,23-6-3)17-13-14-16-18-19-20(14)12-10-8-7-9-11(12)15-13/h7-10H,4-6H2,1-3H3.
What are the key properties of triethoxy(tetrazolo[1,5-a]quinoxalin-4-ylimino)-λ5-phosphane?
triethoxy(tetrazolo[1,5-a]quinoxalin-4-ylimino)-λ5-phosphane has a molecular weight of 350.32 g/mol, XLogP of 3.36, 7 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for triethoxy(tetrazolo[1,5-a]quinoxalin-4-ylimino)-λ5-phosphane is sourced from PubChem (CID 4193241), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).