SMILES:
CN=C1SC2Cc3cc(C#N)ccc3C2(O)N1CMolecular Processing
Molecular formula
C13H13N3OS
Molecular weight
259.33
Exact mass
259.0779
XLogP
1.29
TPSA
59.62
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
0
Heavy atoms
18
Rings
3
Aromatic rings
1
Saturated rings
1
Aliphatic rings
2
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.385
Molar refractivity
71.26
Supplementary Information
جارٍ جلب التفاصيل…
مشارك في 1 تفاعل→