Chemical ID: 4232358

CCC(CC)NC1=NS(=O)(=O)c2c1cccc2
Chemical ID:
4232358
Name [?]:
N-(1-ethylpropyl)-9,9-dioxo-9$l^{6}-thia-8-azabicyclo[4.3.0]nona-1,3,5,7-tetraen-7-amine
SMILES [?]:
CCC(CC)NC1=NS(=O)(=O)c2c1cccc2
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C12H16N2O2S
All Atoms:17
Heavy Atoms:17
Chiral Atoms:0
ZAP Information [?]
Total:8.80894
Area:418.751
Solvation:-1.65984
Coulombic:-19.9966
Bond Count [?]
All:18
Single:12
Double:6
Rotors:4
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:252.334
H-Bond Donors:1
H-Bond Acceptors:4
XLogP:2.69
LogP (Chemaxon):2.61

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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