CC(C)C1=C(C2=C(N1CC3=CC=CC=C3)C=C(C=C2)O)C(=O)NCC4=CC(=C(C=C4)F)F
이름: 1-benzyl-N-[(3,4-difluorophenyl)methyl]-6-hydroxy-2-propan-2-ylindole-3-carboxamide
SMILES: CC(C)C1=C(C2=C(N1CC3=CC=CC=C3)C=C(C=C2)O)C(=O)NCC4=CC(=C(C=C4)F)F

Molecular Processing

Molecular formula
C26H24F2N2O2
Molecular weight
434.49
Exact mass
434.1806
XLogP
5.73
TPSA
54.26
H-bond donors
2
H-bond acceptors
2
Rotatable bonds
6
Heavy atoms
32
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.192
Molar refractivity
120.76

Supplementary Information

InChIKey: NCHGPLXPTROIAW-UHFFFAOYSA-N
동의어
SCHEMBL805671CHEMBL3655406NCHGPLXPTROIAW-UHFFFAOYSA-NBDBM101036US8524917, 91-Benzyl-N-(3,4-difluorobenzyl)-6-hydroxy-2-isopropyl-1H-indole-3-carboxamide
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