C1C(NC(=O)N1C2=CC3=C(C=C2)N=CS3)C(F)(F)F
이름: 1-(1,3-benzothiazol-6-yl)-4-(trifluoromethyl)imidazolidin-2-one
SMILES: C1C(NC(=O)N1C2=CC3=C(C=C2)N=CS3)C(F)(F)F

Molecular Processing

Molecular formula
C11H8F3N3OS
Molecular weight
287.27
Exact mass
287.034
XLogP
2.76
TPSA
45.23
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
1
Heavy atoms
19
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.273
Molar refractivity
65.34

Supplementary Information

InChIKey: QBRCVTPOLPCUSQ-UHFFFAOYSA-N
동의어
1-Benzothiazol-6-yl-4-trifluoromethyl-imidazolidin-2-oneSCHEMBL37894733,1-Benzothiazol-6-yl-4-trifluoromethyl-imidazolidin-2-one
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