2,4-Dichloro-pyrimidine-5-carboxylic acid-tert-butylamide

HCID 22326752
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Basic information

Standard SMILES
CC(C)(C)NC(=O)c1cnc(Cl)nc1Cl
InChIKey
YSKVWBUITNKPDL-UHFFFAOYSA-N
Molecular formula
C9H11Cl2N3O
Average molar mass
248.11 g/mol

Names & identifiers

Preferred name
2,4-Dichloro-pyrimidine-5-carboxylic acid-tert-butylamide
IUPAC
N-tert-butyl-2,4-dichloropyrimidine-5-carboxamide

Names & synonyms

389606-35-32,4-Dichloro-pyrimidine-5-carboxylic acid-tert-butylamideN-(tert-butyl)-2,4-dichloropyrimidine-5-carboxamideSCHEMBL4768472YSKVWBUITNKPDL-UHFFFAOYSA-NSB58781DB-1100242,4-Dichloro-pyrimidine-5-carboxylicacid-tert-butylamide2,4-Dichloro-pyrimidine-5-carboxylic Acid Tert-ButylamideN-TERT-BUTYL-2,4-DICHLOROPYRIMIDINE-5-CARBOXAMIDE

Database identifiers

PubChem CID
22326752

Properties

Computed structural properties

XLogP
2.4
Topological polar surface area
54.9 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
2
Heavy atoms
15

Related reactions

3 records
New reaction record

Linked notes

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