CAS: 155637-51-7
名称: N-pyridin-4-yl-1,2-benzoxazol-3-amine
SMILES:
C1=CC=C2C(=C1)C(=NO2)NC3=CC=NC=C3Molecular Processing
Molecular formula
C12H9N3O
Molecular weight
211.22
Exact mass
211.0746
XLogP
2.97
TPSA
50.95
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
2
Heavy atoms
16
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0
Molar refractivity
61.53
Supplementary Information
InChIKey: XLRRBYUEMIWKOJ-UHFFFAOYSA-N
同義語
155637-51-71,2-Benzisoxazol-3-amine, N-4-pyridinyl-DTXSID00431572RefChem:215607DTXCID90382403N-(Pyridin-4-yl)benzo[d]isoxazol-3-amineSCHEMBL8056494XLRRBYUEMIWKOJ-UHFFFAOYSA-N3-(4-pyridinylamino)-1,2-benzisoxazoleN-(PYRIDIN-4-YL)-1,2-BENZOXAZOL-3-AMINE
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