Chemical ID: 4161032

CCOc1ccccc1NC(=O)Cn2cnc3c(c2=O)c(c(s3)C)c4ccc(cc4)F
Chemical ID:
4161032
Name [?]:
N-(2-ethoxyphenyl)-2-[7-(4-fluorophenyl)-8-methyl-5-oxo-9-thia-2,4-diazabicyclo[4.3.0]nona-2,7,10-trien-4-yl]-acetamide
SMILES [?]:
CCOc1ccccc1NC(=O)Cn2cnc3c(c2=O)c(c(s3)C)c4ccc(cc4)F
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C23H20FN3O3S
All Atoms:31
Heavy Atoms:31
Chiral Atoms:0
ZAP Information [?]
Total:10.6359
Area:638.688
Solvation:-5.33129
Coulombic:-54.5582
Bond Count [?]
All:34
Single:23
Double:11
Rotors:7
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:437.488
H-Bond Donors:1
H-Bond Acceptors:4
XLogP:3.13
LogP (Chemaxon):3.95

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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