Methyl [3,5-bis(trifluoromethyl)benzyl][(4-cyano-5'-isopropyl-2'-methoxybiphenyl-2-yl)methyl]carbamate

HCID 11613843

Basic information

Standard SMILES
COC(=O)N(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)Cc1cc(C#N)ccc1-c1cc(C(C)C)ccc1OC
InChIKey
GAHHWDHNPJYTSC-UHFFFAOYSA-N
Molecular formula
C29H26F6N2O3
Average molar mass
564.5 g/mol

Names & identifiers

Preferred name
Methyl [3,5-bis(trifluoromethyl)benzyl][(4-cyano-5'-isopropyl-2'-methoxybiphenyl-2-yl)methyl]carbamate
IUPAC
methyl N-[[3,5-bis(trifluoromethyl)phenyl]methyl]-N-[[5-cyano-2-(2-methoxy-5-propan-2-ylphenyl)phenyl]methyl]carbamate

Names & synonyms

CHEMBL1290759Methyl [3,5-bis(trifluoromethyl)benzyl][(4-cyano-5'-isopropyl-2'-methoxybiphenyl-2-yl)methyl]carbamateSCHEMBL9886092BDBM50331762methyl 3,5-bis(trifluoromethyl)benzyl((4-cyano-5''-isopropyl-2''-methoxybiphenyl-2-yl)methyl)carbamate

Database identifiers

PubChem CID
11613843
ChEMBL
CHEMBL1290759

Properties

Computed structural properties

XLogP
7.3
Topological polar surface area
62.6 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
10
Rotatable bonds
8
Heavy atoms
40

Related reactions

3 records

Compound notes

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