4-(Aminocarbonyl)-2-chloro-3-[(1-cyclopropylethyl)amino]benzoic acid

HCID 57748635
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Basic information

Standard SMILES
CC(Nc1c(C(N)=O)ccc(C(=O)O)c1Cl)C1CC1
InChIKey
FSGHCFYJAFYQJH-UHFFFAOYSA-N
Molecular formula
C13H15ClN2O3
Average molar mass
282.72 g/mol

Names & identifiers

Preferred name
4-(Aminocarbonyl)-2-chloro-3-[(1-cyclopropylethyl)amino]benzoic acid
IUPAC
4-carbamoyl-2-chloro-3-(1-cyclopropylethylamino)benzoic acid

Names & synonyms

4-(aminocarbonyl)-2-chloro-3-[(1-cyclopropylethyl)amino]benzoic acid1149387-17-6SCHEMBL2427259FSGHCFYJAFYQJH-UHFFFAOYSA-NDB-348727

Database identifiers

PubChem CID
57748635

Properties

Computed structural properties

XLogP
2.7
Topological polar surface area
92.4 Ų
Hydrogen bond donors
3
Hydrogen bond acceptors
4
Rotatable bonds
5
Heavy atoms
19

Related reactions

1 records
New reaction record

Compound notes

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