8-iodo-2-(trifluoromethyl)-6,11-dihydro-5H-pyrido[2,3-b][1,5]benzodiazepine

HCID 66901596
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Basic information

Standard SMILES
FC(F)(F)c1ccc2c(n1)Nc1ccc(I)cc1NC2
InChIKey
LAHDDXNXTFNTNO-UHFFFAOYSA-N
Molecular formula
C13H9F3IN3
Average molar mass
391.13 g/mol

Names & identifiers

Preferred name
8-iodo-2-(trifluoromethyl)-6,11-dihydro-5H-pyrido[2,3-b][1,5]benzodiazepine
IUPAC
8-iodo-2-(trifluoromethyl)-6,11-dihydro-5H-pyrido[3,2-c][1,5]benzodiazepine

Names & synonyms

8-iodo-2-(trifluoromethyl)-6,11-dihydro-5H-pyrido[2,3-b][1,5]benzodiazepineSCHEMBL1085261

Database identifiers

PubChem CID
66901596

Properties

Computed structural properties

XLogP
3.9
Topological polar surface area
37 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
6
Rotatable bonds
0
Heavy atoms
20

Related reactions

6 records
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Compound notes

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