이름: 5-(Tetrahydropyran-4-carbonyl)-3-(2,2,2-trifluoroacetylamino)thiophene-2-carboxylic acid methyl ester
SMILES:
COC(=O)c1sc(C(=O)C2CCOCC2)cc1NC(=O)C(F)(F)FMolecular Processing
Molecular formula
C14H14F3NO5S
Molecular weight
365.33
Exact mass
365.0545
XLogP
2.64
TPSA
81.7
H-bond donors
1
H-bond acceptors
6
Rotatable bonds
4
Heavy atoms
24
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.5
Molar refractivity
78.22
Supplementary Information
상세 정보 불러오는 중…
2개 반응에 참여→