Chemical ID: 4409487

Cc1cc(c(c(c1)C)S(=O)(=O)N2CCCN(CC2)S(=O)(=O)c3c(cc(cc3C)C)C)C
Chemical ID:
4409487
Name [?]:
1,4-bis[(2,4,6-trimethylphenyl)sulfonyl]-1,4-diazepane
SMILES [?]:
Cc1cc(c(c(c1)C)S(=O)(=O)N2CCCN(CC2)S(=O)(=O)c3c(cc(cc3C)C)C)C
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C23H32N2O4S2
All Atoms:31
Heavy Atoms:31
Chiral Atoms:2
ZAP Information [?]
Total:12.2216
Area:598.579
Solvation:-2.74284
Coulombic:-16.3145
Bond Count [?]
All:33
Single:23
Double:10
Rotors:4
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:464.643
H-Bond Donors:0
H-Bond Acceptors:6
XLogP:3.94
LogP (Chemaxon):4.85

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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