C1CC1C(=O)NC2=CC=C(C=C2)SC3=CN=CC(=N3)Cl
이름: N-[4-(6-chloropyrazin-2-yl)sulfanylphenyl]cyclopropanecarboxamide
SMILES: C1CC1C(=O)NC2=CC=C(C=C2)SC3=CN=CC(=N3)Cl

Molecular Processing

Molecular formula
C14H12ClN3OS
Molecular weight
305.79
Exact mass
305.039
XLogP
3.63
TPSA
54.88
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
4
Heavy atoms
20
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.214
Molar refractivity
78.96

Supplementary Information

InChIKey: KVMJJOWJAYGMLR-UHFFFAOYSA-N
동의어
SCHEMBL375090KVMJJOWJAYGMLR-UHFFFAOYSA-NN-(4-(6-chloropyrazin-2-ylthio)phenyl)cyclopropanecarboxamide
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