이름: Intermediate 3
SMILES:
CC(C)(C)OC(=O)NCCCN(CCc1cccs1)S(=O)(=O)c1cccc2cnccc12Molecular Processing
Molecular formula
C23H29N3O4S2
Molecular weight
475.64
Exact mass
475.1599
XLogP
4.44
TPSA
88.6
H-bond donors
1
H-bond acceptors
6
Rotatable bonds
9
Heavy atoms
32
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.391
Molar refractivity
127.38
Supplementary Information
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