CC1=C(SC(=N1)N2CCN(C2=O)CC3=CC=C(C=C3)F)C(=O)O
CAS: 1072802-48-2
الاسم: 2-[3-[(4-fluorophenyl)methyl]-2-oxoimidazolidin-1-yl]-4-methyl-1,3-thiazole-5-carboxylic acid
SMILES: CC1=C(SC(=N1)N2CCN(C2=O)CC3=CC=C(C=C3)F)C(=O)O

Molecular Processing

Molecular formula
C15H14FN3O3S
Molecular weight
335.36
Exact mass
335.074
XLogP
2.73
TPSA
73.74
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
4
Heavy atoms
23
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.267
Molar refractivity
83.36

Supplementary Information

InChIKey: DTOQVGLZXNUOHE-UHFFFAOYSA-N
مرادفات
2-(3-(4-fluorobenzyl)-2-oxoimidazolidin-1-yl)-4-methylthiazole-5-carboxylic acid1072802-48-2SCHEMBL242074DTOQVGLZXNUOHE-UHFFFAOYSA-NDB-346037
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