CC(C)(C)OC(=O)C(C1=CC=CC=C1)NC(=O)C2=CC=CC=C2SSC3=CC=CC=C3C(=O)NC(C4=CC=CC=C4)C(=O)OC(C)(C)C
الاسم: tert-butyl 2-[[2-[[2-[[2-[(2-methylpropan-2-yl)oxy]-2-oxo-1-phenylethyl]carbamoyl]phenyl]disulfanyl]benzoyl]amino]-2-phenylacetate
SMILES: CC(C)(C)OC(=O)C(C1=CC=CC=C1)NC(=O)C2=CC=CC=C2SSC3=CC=CC=C3C(=O)NC(C4=CC=CC=C4)C(=O)OC(C)(C)C

Molecular Processing

Molecular formula
C38H40N2O6S2
Molecular weight
684.88
Exact mass
684.2328
XLogP
8.11
TPSA
110.8
H-bond donors
2
H-bond acceptors
8
Rotatable bonds
11
Heavy atoms
48
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.263
Molar refractivity
189.59

Supplementary Information

InChIKey: UGJWDYLEAASYCL-UHFFFAOYSA-N
مرادفات
SCHEMBL6227512UGJWDYLEAASYCL-UHFFFAOYSA-N(2-{2-[(tert-Butoxycarbonyl-phenyl-methyl)carbamoyl]-phenyldisulfanyl}-benzoylamino)phenyl-acetic acid tert-butyl ester
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