COC(=O)[C@@H](Cc1ccc2c(c1)CCN(Cc1ccc(OC)cc1OC)S2(=O)=O)NC(=O)OC(C)(C)C
SMILES: COC(=O)[C@@H](Cc1ccc2c(c1)CCN(Cc1ccc(OC)cc1OC)S2(=O)=O)NC(=O)OC(C)(C)C

Molecular Processing

Molecular formula
C26H34N2O8S
Molecular weight
534.63
Exact mass
534.2036
XLogP
3.06
TPSA
120.47
H-bond donors
1
H-bond acceptors
8
Rotatable bonds
8
Heavy atoms
37
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
0
Formal charge
0
Heteroatoms
11
Covalent units
1
Fraction Csp3
0.462
Molar refractivity
136.17

Supplementary Information

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