이름: 2-(3-benzyl-2-oxoimidazolidin-1-yl)-N-[(3,4-difluorophenyl)methyl]-4-methyl-1,3-thiazole-5-carboxamide
SMILES:
CC1=C(SC(=N1)N2CCN(C2=O)CC3=CC=CC=C3)C(=O)NCC4=CC(=C(C=C4)F)FMolecular Processing
Molecular formula
C22H20F2N4O2S
Molecular weight
442.49
Exact mass
442.1275
XLogP
4.1
TPSA
65.54
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
6
Heavy atoms
31
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.227
Molar refractivity
113.97
Supplementary Information
InChIKey: XIZGLPHWGRSNAW-UHFFFAOYSA-N
동의어
SCHEMBL240443XIZGLPHWGRSNAW-UHFFFAOYSA-N2-(3-benzyl-2-oxoimidazolidin-1-yl)-N-(3,4-difluorobenzyl)-4-methylthiazole-5-carboxamide
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