C#CC1CC(N2CCc3cc(OC)ccc3NC2=O)CCN1c1cc(C(=O)N2CCc3cc(F)ccc32)ncc1[Si](C)(C)C
名称: 3-[2′-(5-fluoro-2,3-dihydro-indole-1-carbonyl)-5′-trimethylsilanyl-ethynyl-3,4,5,6-tetrahydro-2H-[1,4′]bipyridinyl-4-yl]-7-methoxy-1,3,4,5-tetrahydro-benzo[d][1,3]-diazepin-2-one
SMILES: C#CC1CC(N2CCc3cc(OC)ccc3NC2=O)CCN1c1cc(C(=O)N2CCc3cc(F)ccc32)ncc1[Si](C)(C)C

Molecular Processing

Molecular formula
C34H38FN5O3Si
Molecular weight
611.79
Exact mass
611.2728
XLogP
5.04
TPSA
78.01
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
5
Heavy atoms
44
Rings
6
Aromatic rings
3
Saturated rings
1
Aliphatic rings
3
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.382
Molar refractivity
174.41

Supplementary Information

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