COC1=CC=CC=C1C2=CC=C3N2N=C(N=C3)S(=O)C
이름: 7-(2-methoxyphenyl)-2-methylsulfinylpyrrolo[2,1-f][1,2,4]triazine
SMILES: COC1=CC=CC=C1C2=CC=C3N2N=C(N=C3)S(=O)C

Molecular Processing

Molecular formula
C14H13N3O2S
Molecular weight
287.34
Exact mass
287.0728
XLogP
2.14
TPSA
56.49
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
20
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.143
Molar refractivity
77.31

Supplementary Information

InChIKey: PVWZOJVFNZLPNX-UHFFFAOYSA-N
동의어
SCHEMBL519194PVWZOJVFNZLPNX-UHFFFAOYSA-N2-Methane sulfinyl-7-(2-methoxy-phenyl)-pyrrolo[2,1-f][1,2,4]triazine2-Methanesulfinyl-7-(2-methoxy-phenyl)-pyrrolo[2,1-f][1, 2,4]triazine2-Methanesulfinyl-7-(2-methoxy-phenyl)-pyrrolo[2,1-f][1,2,4]triazine
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