Chemical ID: 6746733

COc1ccc(cc1)N2C(=O)CC(C2=O)[NH+]3CCN(CC3)c4ccccc4F
Chemical ID:
6746733
Name [?]:
3-[4-(2-fluorophenyl)-2,3,5,6-tetrahydropyrazin-1-yl]-1-(4-methoxyphenyl)-pyrrolidine-2,5-dione
SMILES [?]:
COc1ccc(cc1)N2C(=O)CC(C2=O)[NH+]3CCN(CC3)c4ccccc4F
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C21H23FN3O3+
All Atoms:51
Heavy Atoms:28
Chiral Atoms:1
ZAP Information [?]
Total:-24.3274
Area:579.334
Solvation:-38.8108
Coulombic:-3.59661
Bond Count [?]
All:31
Single:23
Double:8
Rotors:4
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:384.424
H-Bond Donors:1
H-Bond Acceptors:6
XLogP:2.42
LogP (Chemaxon):2.69

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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