Chemical ID: 4449989

c1cc(ccc1COc2ccc(cc2Cl)C=C3C(=O)NC(=O)NC3=O)C(=O)O
Chemical ID:
4449989
Name [?]:
4-[[2-chloro-4-[(2,4,6-trioxohexahydropyrimidin-5-ylidene)methyl]phenoxy]methyl]benzoic acid
SMILES [?]:
c1cc(ccc1COc2ccc(cc2Cl)C=C3C(=O)NC(=O)NC3=O)C(=O)O
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C19H13ClN2O6
All Atoms:28
Heavy Atoms:28
Chiral Atoms:0
ZAP Information [?]
Total:9.54745
Area:602.943
Solvation:-5.52613
Coulombic:-87.2677
Bond Count [?]
All:30
Single:19
Double:11
Rotors:5
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:400.769
H-Bond Donors:3
H-Bond Acceptors:8
XLogP:2.55
LogP (Chemaxon):2.25

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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