Chemical ID: 4126204

CC1CCCCN1Cc2c(nnn2c3c(non3)N)C(=O)NN=Cc4cc(c(c(c4)OC)OC(=O)C)OC
Chemical ID:
4126204
Name [?]:
[4-[[1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(2-methyl-1-piperidyl)methyl]triazol-4-yl]carbonylaminoiminomethyl]-2,6-dimethoxy-phenyl] acetate
SMILES [?]:
CC1CCCCN1Cc2c(nnn2c3c(non3)N)C(=O)NN=Cc4cc(c(c(c4)OC)OC(=O)C)OC
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C23H29N9O6
All Atoms:38
Heavy Atoms:38
Chiral Atoms:2
ZAP Information [?]
Total:10.5791
Area:726.377
Solvation:-7.58032
Coulombic:-81.0179
Bond Count [?]
All:41
Single:31
Double:10
Rotors:11
Chiral:1
Rigid Segments:9
Chemical Properties
Molecular Weight:527.533
H-Bond Donors:3
H-Bond Acceptors:9
XLogP:2.67
LogP (Chemaxon):1.18

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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