Chemical ID: 5882062

CCN(CC(=O)Nc1cc(nn1c2ccccc2)C(C)(C)C)C(=O)c3ccc(cc3)Br
Chemical ID:
5882062
Name [?]:
4-bromo-N-ethyl-N-[(2-phenyl-5-tert-butyl-pyrazol-3-yl)carbamoylmethyl]benzamide
SMILES [?]:
CCN(CC(=O)Nc1cc(nn1c2ccccc2)C(C)(C)C)C(=O)c3ccc(cc3)Br
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C24H27BrN4O2
All Atoms:31
Heavy Atoms:31
Chiral Atoms:0
ZAP Information [?]
Total:13.075
Area:673.722
Solvation:-3.76807
Coulombic:-44.8383
Bond Count [?]
All:33
Single:23
Double:10
Rotors:9
Chiral:0
Rigid Segments:7
Chemical Properties
Molecular Weight:483.401
H-Bond Donors:1
H-Bond Acceptors:4
XLogP:5.05
LogP (Chemaxon):5.33

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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