Basic information
- Standard SMILES
COC(=O)c1ccc(C)c(NC(=O)c2cc(Cl)nc3ccccc23)c1C- InChIKey
ISGOBJKTOCHBHN-UHFFFAOYSA-N- Molecular formula
- C20H17ClN2O3
- Average molar mass
- 368.8 g/mol
Names & identifiers
- Preferred name
- Methyl 3-[(2-chloroquinoline-4-carbonyl)amino]-2,4-dimethyl-benzoate
- IUPAC
- methyl 3-[(2-chloroquinoline-4-carbonyl)amino]-2,4-dimethylbenzoate
Names & synonyms
1529761-37-2SCHEMBL15398469ISGOBJKTOCHBHN-UHFFFAOYSA-Nmethyl 3-[(2-chloroquinoline-4-carbonyl)amino]-2,4-dimethyl-benzoateDA-44093methyl 3-(2-chloroquinoline-4-carboxamido)-2,4-dimethylbenzoatemethyl 3[(2-chloroquinoline-4-carbonyl)amino]-2,4-dimethyl-benzoate
Database identifiers
- PubChem CID
- 86707367
Properties
Computed structural properties
- XLogP
- 4.6
- Topological polar surface area
- 68.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 529
Related reactions
4 records
Compound notes
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