Chemical ID: 4637932

c1ccc(cc1)CN2Cc3cccc(c3C2=O)C(=O)O
Chemical ID:
4637932
Name [?]:
2-benzyl-3-oxo-isoindoline-4-carboxylic acid
SMILES [?]:
c1ccc(cc1)CN2Cc3cccc(c3C2=O)C(=O)O
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C16H13NO3
All Atoms:20
Heavy Atoms:20
Chiral Atoms:0
ZAP Information [?]
Total:7.61442
Area:439.501
Solvation:-3.37309
Coulombic:-45.2331
Bond Count [?]
All:22
Single:14
Double:8
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:267.279
H-Bond Donors:1
H-Bond Acceptors:4
XLogP:2.58
LogP (Chemaxon):2.21

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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