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N-[[4,6-bis(dimethylamino)-1,3,5-triazin-2-yl]carbamoyl]-2,6-difluorobenzamide

HCID 326530
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Basic information

CAS
64862-28-8
Standard SMILES
CN(C)c1nc(NC(=O)NC(=O)c2c(F)cccc2F)nc(N(C)C)n1
InChIKey
ADNSNBWGONLUBY-UHFFFAOYSA-N
Molecular formula
C15H17F2N7O2
Average molar mass
365.34 g/mol
Monoisotopic mass
365.14117913

Names & identifiers

Preferred name
N-[[4,6-bis(dimethylamino)-1,3,5-triazin-2-yl]carbamoyl]-2,6-difluorobenzamide
IUPAC
N-[[4,6-bis(dimethylamino)-1,3,5-triazin-2-yl]carbamoyl]-2,6-difluorobenzamide

Names & synonyms

64862-28-8N-[[4,6-bis(dimethylamino)-1,3,5-triazin-2-yl]carbamoyl]-2,6-difluorobenzamideN-{[4,6-Bis(dimethylamino)-1,3,5-triazin-2-yl]carbamoyl}-2,6-difluorobenzamideNSC298163DTXSID40315908NSC-298163

Database identifiers

CAS
64862-28-8
PubChem CID
326530
DTXSID
DTXSID40315908

Properties

Computed structural properties

XLogP
2.4
Topological polar surface area
103 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
9
Rotatable bonds
4
Heavy atoms
26
Formal charge
0
Complexity
482

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Compound notes

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