ethyl 1-[2-(dimethylamino)ethyl]-8-(methylsulfanyl)-1H-pyrazolo[4,3-h]quinazoline-3-carboxylate

HCID 67975437
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Basic information

Standard SMILES
CCOC(=O)c1nn(CCN(C)C)c2c1ccc1cnc(SC)nc12
InChIKey
NZZUPYUHSNPFEE-UHFFFAOYSA-N
Molecular formula
C17H21N5O2S
Average molar mass
359.4 g/mol
Monoisotopic mass
359.1415961

Names & identifiers

Preferred name
ethyl 1-[2-(dimethylamino)ethyl]-8-(methylsulfanyl)-1H-pyrazolo[4,3-h]quinazoline-3-carboxylate
IUPAC
ethyl 1-[2-(dimethylamino)ethyl]-8-methylsulfanylpyrazolo[4,5-h]quinazoline-3-carboxylate

Names & synonyms

SCHEMBL9940569NZZUPYUHSNPFEE-UHFFFAOYSA-Nethyl 1-[2-(dimethylamino)ethyl]-8-(methylsulfanyl)-1H-pyrazolo[4,3-h]quinazoline-3-carboxylate

Database identifiers

PubChem CID
67975437

Properties

Computed structural properties

XLogP
2.6
Topological polar surface area
98.4 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
7
Rotatable bonds
7
Heavy atoms
25

Related reactions

2 records
New reaction record

Compound notes

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