Chemical ID: 6228634

CC(C)(C)NC(=O)c1cnc2n(c1=O)CCS2
Chemical ID:
6228634
Name [?]:
5-oxo-N-tert-butyl-9-thia-2,6-diazabicyclo[4.3.0]nona-1,3-diene-4-carboxamide
SMILES [?]:
CC(C)(C)NC(=O)c1cnc2n(c1=O)CCS2
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C11H15N3O2S
All Atoms:17
Heavy Atoms:17
Chiral Atoms:0
ZAP Information [?]
Total:8.46144
Area:416.607
Solvation:-1.95372
Coulombic:-43.384
Bond Count [?]
All:18
Single:14
Double:4
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:253.322
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:0.27
LogP (Chemaxon):0.35

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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