Chemical ID: 4292549

Cc1ccc(c(c1)OCC(=O)NN=Cc2ccc(cc2)OC(=O)c3ccccc3Br)C(C)C
Chemical ID:
4292549
Name [?]:
[4-[[2-(2-isopropyl-5-methyl-phenoxy)acetyl]aminoiminomethyl]phenyl] 2-bromobenzoate
SMILES [?]:
Cc1ccc(c(c1)OCC(=O)NN=Cc2ccc(cc2)OC(=O)c3ccccc3Br)C(C)C
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C26H25BrN2O4
All Atoms:33
Heavy Atoms:33
Chiral Atoms:0
ZAP Information [?]
Total:12.1034
Area:732.05
Solvation:-6.19785
Coulombic:-47.2652
Bond Count [?]
All:35
Single:23
Double:12
Rotors:10
Chiral:1
Rigid Segments:8
Chemical Properties
Molecular Weight:509.392
H-Bond Donors:1
H-Bond Acceptors:6
XLogP:7.61
LogP (Chemaxon):6.7

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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