Chemical ID: 5844867

COc1cc(ccc1OC(=O)c2ccc(cc2)[N+](=O)[O-])C=NNC(=O)CNc3cccc4c3cccc4
Chemical ID:
5844867
Name [?]:
[2-methoxy-4-[[2-(1-naphthylamino)acetyl]aminoiminomethyl]phenyl] 4-nitrobenzoate
SMILES [?]:
COc1cc(ccc1OC(=O)c2ccc(cc2)[N+](=O)[O-])C=NNC(=O)CNc3cccc4c3cccc4
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C27H22N4O6
All Atoms:37
Heavy Atoms:37
Chiral Atoms:0
ZAP Information [?]
Total:7.27147
Area:765.456
Solvation:-11.8649
Coulombic:-69.865
Bond Count [?]
All:40
Single:25
Double:15
Rotors:11
Chiral:1
Rigid Segments:9
Chemical Properties
Molecular Weight:498.487
H-Bond Donors:2
H-Bond Acceptors:10
XLogP:5.59
LogP (Chemaxon):4.78

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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