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Isopropyl 4-(2,6-dichlorobenzamido)pyridin-2-ylcarbamate

HCID 59618162
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Basic information

Standard SMILES
CC(C)OC(=O)Nc1cc(NC(=O)c2c(Cl)cccc2Cl)ccn1
InChIKey
GTKQKZDGUABDNB-UHFFFAOYSA-N
Molecular formula
C16H15Cl2N3O3
Average molar mass
368.2 g/mol
Monoisotopic mass
367.0490467

Names & identifiers

Preferred name
Isopropyl 4-(2,6-dichlorobenzamido)pyridin-2-ylcarbamate
IUPAC
propan-2-yl N-[4-[(2,6-dichlorobenzoyl)amino]-2-pyridinyl]carbamate

Names & synonyms

SCHEMBL1707569GTKQKZDGUABDNB-UHFFFAOYSA-NIsopropyl 4-(2,6-dichlorobenzamido)pyridin-2-ylcarbamate

Database identifiers

PubChem CID
59618162

Properties

Computed structural propertiesFilling in

XLogP
3.7
Topological polar surface area
80.3 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
4
Rotatable bonds
5
Heavy atoms
24
Formal charge
0
Complexity
440

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Related reactions

2 records
New reaction record
HRID 186670 reaction equation
HRID 186670As productTraining data from https://doi.org/10.1039/C8SC04228D (6/10)
HRID 449876 reaction equation
HRID 449876As productuspto-grants-2013_07

Compound notes

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