Chemical ID: 3996340

Cc1c(sc2c1c(=O)n(c(n2)S)CC(C)C)C
Chemical ID:
3996340
Name [?]:
4-isobutyl-7,8-dimethyl-3-sulfanyl-9-thia-2,4-diazabicyclo[4.3.0]nona-2,7,10-trien-5-one
SMILES [?]:
Cc1c(sc2c1c(=O)n(c(n2)S)CC(C)C)C
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C12H16N2OS2
All Atoms:17
Heavy Atoms:17
Chiral Atoms:0
ZAP Information [?]
Total:9.41959
Area:425.095
Solvation:-1.20778
Coulombic:-25.7518
Bond Count [?]
All:18
Single:14
Double:4
Rotors:2
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:268.4
H-Bond Donors:0
H-Bond Acceptors:1
XLogP:1.65
LogP (Chemaxon):3.64

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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