이름: 2-chloro-4-(N-formylpiperazino)-7,8-dihydro-6H-thiopyrano[3,2-d]pyrimidine
SMILES:
O=CN1CCN(c2nc(Cl)nc3c2SCCC3)CC1Molecular Processing
Molecular formula
C12H15ClN4OS
Molecular weight
298.8
Exact mass
298.0655
XLogP
1.45
TPSA
49.33
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
2
Heavy atoms
19
Rings
3
Aromatic rings
1
Saturated rings
1
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.583
Molar refractivity
75.94
Supplementary Information
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