N-[4-methyl-3-(9H-pyrimido[4,5-b]indol-7-yl)phenyl]-3-(trifluoromethyl)benzamide

HCID 25152248
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Basic information

Standard SMILES
Cc1ccc(NC(=O)c2cccc(C(F)(F)F)c2)cc1-c1ccc2c(c1)[nH]c1ncncc12
InChIKey
BBKHPJVZSAVFAN-UHFFFAOYSA-N
Molecular formula
C25H17F3N4O
Average molar mass
446.4 g/mol

Names & identifiers

Preferred name
N-[4-methyl-3-(9H-pyrimido[4,5-b]indol-7-yl)phenyl]-3-(trifluoromethyl)benzamide
IUPAC
N-[4-methyl-3-(9H-pyrimido[4,5-b]indol-7-yl)phenyl]-3-(trifluoromethyl)benzamide

Names & synonyms

N-[4-methyl-3-(9H-pyrimido[4,5-b]indol-7-yl)phenyl]-3-(trifluoromethyl)benzamideSCHEMBL2304084

Database identifiers

PubChem CID
25152248

Properties

Computed structural properties

XLogP
5.7
Topological polar surface area
70.7 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
6
Rotatable bonds
3
Heavy atoms
33

Related reactions

2 records
New reaction record

Compound notes

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