الاسم: 8-(7-hydroxy-2,3-dihydro-1,4-benzodioxin-6-yl)-6-(4-methoxybenzyl)-6,8-dihydro-7H-[1,3]thiazolo[5,4-e]indol-7-one
SMILES:
COc1ccc(CN2C(=O)C(c3cc4c(cc3O)OCCO4)c3c2ccc2ncsc32)cc1Molecular Processing
Molecular formula
C25H20N2O5S
Molecular weight
460.51
Exact mass
460.1093
XLogP
4.46
TPSA
81.12
H-bond donors
1
H-bond acceptors
7
Rotatable bonds
4
Heavy atoms
33
Rings
6
Aromatic rings
4
Saturated rings
0
Aliphatic rings
2
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.2
Molar refractivity
124.74
Supplementary Information
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