Chemical ID: 4161710

COc1ccc(cc1OC)c2csc3c2c(=O)n(cn3)CC(=O)N
Chemical ID:
4161710
Name [?]:
2-[7-(3,4-dimethoxyphenyl)-5-oxo-9-thia-2,4-diazabicyclo[4.3.0]nona-2,7,10-trien-4-yl]acetamide
SMILES [?]:
COc1ccc(cc1OC)c2csc3c2c(=O)n(cn3)CC(=O)N
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C16H15N3O4S
All Atoms:24
Heavy Atoms:24
Chiral Atoms:0
ZAP Information [?]
Total:6.14097
Area:520.894
Solvation:-6.88136
Coulombic:-59.7542
Bond Count [?]
All:26
Single:18
Double:8
Rotors:5
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:345.374
H-Bond Donors:2
H-Bond Acceptors:5
XLogP:0.26
LogP (Chemaxon):0.82

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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