Chemical ID: 5879248

CCCCOc1ccc(cc1)C(=O)Oc2cc(nn2c3ccc(cc3)Cl)C(C)(C)C
Chemical ID:
5879248
Name [?]:
[2-(4-chlorophenyl)-5-tert-butyl-pyrazol-3-yl] 4-butoxybenzoate
SMILES [?]:
CCCCOc1ccc(cc1)C(=O)Oc2cc(nn2c3ccc(cc3)Cl)C(C)(C)C
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C24H27ClN2O3
All Atoms:30
Heavy Atoms:30
Chiral Atoms:0
ZAP Information [?]
Total:14.3334
Area:691.815
Solvation:-2.96196
Coulombic:-36.2729
Bond Count [?]
All:32
Single:23
Double:9
Rotors:9
Chiral:0
Rigid Segments:7
Chemical Properties
Molecular Weight:426.936
H-Bond Donors:0
H-Bond Acceptors:3
XLogP:6.93
LogP (Chemaxon):6.67

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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