이름: 1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-amine;hydrochloride
SMILES:
CC1=C(C(=NO1)C)CN2C=C(C=N2)N.ClMolecular Processing
Molecular formula
C9H13ClN4O
Molecular weight
228.68
Exact mass
228.0778
XLogP
1.54
TPSA
69.87
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
2
Heavy atoms
15
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
2
Fraction Csp3
0.333
Molar refractivity
58.97
Supplementary Information
InChIKey: LQCGBFPZKXVAJU-UHFFFAOYSA-N
동의어
SCHEMBL1278372LQCGBFPZKXVAJU-UHFFFAOYSA-N1((3,5-dimethylisoxazol-4-yl)methyl)-1H-pyrazol-4-amine hydrochloride1-((3,5-dimethylisoxazol-4-yl)methyl)-1H-pyrazol-4-amine hydrochloride1-((3,5-dimethylisoxazol-4-yl)methyl)-1H-pyrazol-4-amine-hydrochloride
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