C1=C(c2cccnc2Oc2ccc(Nc3nc4ccccc4s3)cc2)CCNC1
Name: N-(4-(3-(1,2,3,6-tetrahydropyridin-4-yl)pyridin-2-yloxy)phenyl)benzo[d]thiazol-2-amine
SMILES: C1=C(c2cccnc2Oc2ccc(Nc3nc4ccccc4s3)cc2)CCNC1

Molecular Processing

Molecular formula
C23H20N4OS
Molecular weight
400.51
Exact mass
400.1358
XLogP
5.6
TPSA
59.07
H-bond donors
2
H-bond acceptors
6
Rotatable bonds
5
Heavy atoms
29
Rings
5
Aromatic rings
4
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.13
Molar refractivity
119.12

Supplementary Information

Details werden geladen…

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