CCOC(=O)CC1=CC2=C(C=C1)S(=O)(=O)C3=CC=CC=C3N2C
الاسم: ethyl 2-(10-methyl-5,5-dioxophenothiazin-2-yl)acetate
SMILES: CCOC(=O)CC1=CC2=C(C=C1)S(=O)(=O)C3=CC=CC=C3N2C

Molecular Processing

Molecular formula
C17H17NO4S
Molecular weight
331.39
Exact mass
331.0878
XLogP
2.71
TPSA
63.68
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
3
Heavy atoms
23
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.235
Molar refractivity
86.74

Supplementary Information

InChIKey: QDRXDCRPSKERGL-UHFFFAOYSA-N
مرادفات
SCHEMBL2669525QDRXDCRPSKERGL-UHFFFAOYSA-Nethyl (10-methyl-5,5-dioxo-5,10-dihydrophenothiazin-2-yl)acetate
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