이름: 4-diallylamino-2-chloro-7-methylthieno[3,2-d]pyrimidine
SMILES:
C=CCN(CC=C)c1nc(Cl)nc2c(C)csc12Molecular Processing
Molecular formula
C13H14ClN3S
Molecular weight
279.8
Exact mass
279.0597
XLogP
3.83
TPSA
29.02
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
5
Heavy atoms
18
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.231
Molar refractivity
79.77
Supplementary Information
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