Cc1nc(-c2ccc(Cl)cc2)sc1C(=O)NC1CCCNC1
SMILES: Cc1nc(-c2ccc(Cl)cc2)sc1C(=O)NC1CCCNC1

Molecular Processing

Molecular formula
C16H18ClN3OS
Molecular weight
335.86
Exact mass
335.0859
XLogP
3.25
TPSA
54.02
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
22
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.375
Molar refractivity
90.65

Supplementary Information

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