4,7-Dichloro-8-methyl-3-quinolinecarboxamide

HCID 57763233

Notes Reactions

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Basic information

CAS: 801315-36-6
Standard SMILES: Cc1c(Cl)ccc2c(Cl)c(C(N)=O)cnc12
InChIKey: IPYKCAARODQBKY-UHFFFAOYSA-N
Molecular formula: C11H8Cl2N2O
Average molar mass: 255.1 g/mol
Monoisotopic mass: 254.00136824

Names & identifiers

Preferred name: 4,7-Dichloro-8-methyl-3-quinolinecarboxamide
IUPAC: 4,7-dichloro-8-methylquinoline-3-carboxamide

Names & synonyms

4,7-Dichloro-8-methyl-3-quinolinecarboxamide801315-36-6SCHEMBL2483995IPYKCAARODQBKY-UHFFFAOYSA-NDTXSID3012496364,7-dichloro-8-methylquinoline-3-carboxamide4.7-Dichloro-8-methyl-3-quinolinecarboxamide3-Quinolinecarboxamide, 4,7-dichloro-8-methyl-

Database identifiers

CAS: 801315-36-6
PubChem CID: 57763233
DTXSID: DTXSID301249636

Properties

Computed structural properties

XLogP: 2.7
Topological polar surface area: 56 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 2
Rotatable bonds: 1
Heavy atoms: 16
Formal charge: 0
Complexity: 287

Related reactions

3 records

New reaction record

HRID 230838As productuspto-grants-2009_07

HRID 230841As reactantuspto-grants-2009_07

HRID 230842As reactantuspto-grants-2009_07

Compound notes

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