Chemical ID: 7011393

C=CCN1C(=O)C(=Cc2c(nc3ccccn3c2=O)N4CCCC4)SC1=S
Chemical ID:
7011393
Name [?]:
8-[(3-allyl-4-oxo-2-thioxo-thiazolidin-5-ylidene)methyl]-9-pyrrolidin-1-yl-6,10-diazabicyclo[4.4.0]deca-2,4,8,10-tetraen-7-one
SMILES [?]:
C=CCN1C(=O)C(=Cc2c(nc3ccccn3c2=O)N4CCCC4)SC1=S
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C19H18N4O2S2
All Atoms:45
Heavy Atoms:27
Chiral Atoms:0
ZAP Information [?]
Total:11.8927
Area:573.008
Solvation:-2.43251
Coulombic:-48.8144
Bond Count [?]
All:30
Single:21
Double:9
Rotors:4
Chiral:1
Rigid Segments:4
Chemical Properties
Molecular Weight:398.504
H-Bond Donors:0
H-Bond Acceptors:4
XLogP:1.12
LogP (Chemaxon):3.62

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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