Chemical ID: 6897848

Cc1ccc(cc1C)c2c(sc3c2c(=O)n(cn3)CC(=O)C)C
Chemical ID:
6897848
Name [?]:
4-acetonyl-7-(3,4-dimethylphenyl)-8-methyl-9-thia-2,4-diazabicyclo[4.3.0]nona-2,7,10-trien-5-one
SMILES [?]:
Cc1ccc(cc1C)c2c(sc3c2c(=O)n(cn3)CC(=O)C)C
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C18H18N2O2S
All Atoms:41
Heavy Atoms:23
Chiral Atoms:0
ZAP Information [?]
Total:9.10749
Area:512.678
Solvation:-3.70947
Coulombic:-28.3615
Bond Count [?]
All:25
Single:17
Double:8
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:326.414
H-Bond Donors:0
H-Bond Acceptors:2
XLogP:2.42
LogP (Chemaxon):3.67

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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