Chemical ID: 6478539

CC1Cc2c(c(nn2C)c3ccc(c(c3)OC)OC)C(=NO)C1
Chemical ID:
6478539
Name [?]:
3-(3,4-dimethoxyphenyl)-1,6-dimethyl-6,7-dihydro-5H-indazol-4-one oxime
SMILES [?]:
CC1Cc2c(c(nn2C)c3ccc(c(c3)OC)OC)C(=NO)C1
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C17H21N3O3
All Atoms:23
Heavy Atoms:23
Chiral Atoms:1
ZAP Information [?]
Total:6.63459
Area:494.98
Solvation:-5.73992
Coulombic:-30.9118
Bond Count [?]
All:25
Single:19
Double:6
Rotors:3
Chiral:1
Rigid Segments:4
Chemical Properties
Molecular Weight:315.367
H-Bond Donors:1
H-Bond Acceptors:4
XLogP:2.57
LogP (Chemaxon):1.71

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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