Chemical ID: 5981339

CCOC(=O)C1CCN(CC1)C(=O)c2cc(nn2c3ccc(cc3)C)c4ccccc4
Chemical ID:
5981339
Name [?]:
ethyl 1-[5-phenyl-2-(p-tolyl)pyrazol-3-yl]carbonylpiperidine-4-carboxylate
SMILES [?]:
CCOC(=O)C1CCN(CC1)C(=O)c2cc(nn2c3ccc(cc3)C)c4ccccc4
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C25H27N3O3
All Atoms:31
Heavy Atoms:31
Chiral Atoms:0
ZAP Information [?]
Total:12.6536
Area:662.103
Solvation:-3.89895
Coulombic:-42.8049
Bond Count [?]
All:34
Single:24
Double:10
Rotors:7
Chiral:0
Rigid Segments:7
Chemical Properties
Molecular Weight:417.5
H-Bond Donors:0
H-Bond Acceptors:4
XLogP:4.68
LogP (Chemaxon):3.89

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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