Chemical ID: 4256557

c1ccc(cc1)CNCC2CCS(=O)(=O)C2
Chemical ID:
4256557
Name [?]:
N-[(1,1-dioxothiolan-3-yl)methyl]-1-phenyl-methanamine
SMILES [?]:
c1ccc(cc1)CNCC2CCS(=O)(=O)C2
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C12H17NO2S
All Atoms:16
Heavy Atoms:16
Chiral Atoms:1
ZAP Information [?]
Total:7.29416
Area:429.853
Solvation:-3.45216
Coulombic:-10.9345
Bond Count [?]
All:17
Single:12
Double:5
Rotors:4
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:239.335
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:1.66
LogP (Chemaxon):0.48

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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