Chemical ID: 6890353

CCCCc1ccc(cc1)NC(=O)Cn2cnc3c(c2=O)c(cs3)c4ccc5ccccc5c4
Chemical ID:
6890353
Name [?]:
N-(4-butylphenyl)-2-[7-(2-naphthyl)-5-oxo-9-thia-2,4-diazabicyclo[4.3.0]nona-2,7,10-trien-4-yl]-acetamide
SMILES [?]:
CCCCc1ccc(cc1)NC(=O)Cn2cnc3c(c2=O)c(cs3)c4ccc5ccccc5c4
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C28H25N3O2S
All Atoms:59
Heavy Atoms:34
Chiral Atoms:0
ZAP Information [?]
Total:13.8727
Area:712.545
Solvation:-3.94088
Coulombic:-45.264
Bond Count [?]
All:38
Single:25
Double:13
Rotors:8
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:467.583
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:6.09
LogP (Chemaxon):6.39

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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