名称: 2-(3-chlorothiophen-2-yl)benzoxazole-4-carboxylic acid
SMILES:
O=C(O)c1cccc2oc(-c3sccc3Cl)nc12Molecular Processing
Molecular formula
C12H6ClNO3S
Molecular weight
279.7
Exact mass
278.9757
XLogP
3.91
TPSA
63.33
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
2
Heavy atoms
18
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0
Molar refractivity
69.29
Supplementary Information
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