Chemical ID: 6247149

Cc1ccc(cc1)n2c(=O)c3c(nc2SCC(=O)Nc4nc5ccc(cc5s4)C)CC(S3)C
Chemical ID:
6247149
Name [?]:
N-(6-methylbenzothiazol-2-yl)-2-[[8-methyl-2-oxo-3-(p-tolyl)-9-thia-3,5-diazabicyclo[4.3.0]nona-4,10-dien-4-yl]sulfanyl]acetamide
SMILES [?]:
Cc1ccc(cc1)n2c(=O)c3c(nc2SCC(=O)Nc4nc5ccc(cc5s4)C)CC(S3)C
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C24H22N4O2S3
All Atoms:33
Heavy Atoms:33
Chiral Atoms:1
ZAP Information [?]
Total:13.5614
Area:721.141
Solvation:-4.46711
Coulombic:-49.2963
Bond Count [?]
All:37
Single:26
Double:11
Rotors:6
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:494.655
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:3.81
LogP (Chemaxon):6.1

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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