O=Cc1cnc2c(c1)NC(=O)CS2
名称: 2-oxo-2,3-dihydro-1H-pyrido[2,3-b][1,4]thiazine-7-carboxaldehyde
SMILES: O=Cc1cnc2c(c1)NC(=O)CS2

Molecular Processing

Molecular formula
C8H6N2O2S
Molecular weight
194.21
Exact mass
194.015
XLogP
0.94
TPSA
59.06
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
1
Heavy atoms
13
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.125
Molar refractivity
48.98

Supplementary Information

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