COc1nc(C)nc(NC(=O)NS(=O)(=O)c2ccccc2N)n1
名称: N-(2-aminophenylsulfonyl)-N'-(4-methoxy-6-methyl-1,3,5-triazin-2-yl)urea
SMILES: COc1nc(C)nc(NC(=O)NS(=O)(=O)c2ccccc2N)n1

Molecular Processing

Molecular formula
C12H14N6O4S
Molecular weight
338.35
Exact mass
338.0797
XLogP
0.28
TPSA
149.19
H-bond donors
3
H-bond acceptors
8
Rotatable bonds
4
Heavy atoms
23
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
11
Covalent units
1
Fraction Csp3
0.167
Molar refractivity
81.31

Supplementary Information

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