Chemical ID: 3987324

CCCc1c(c(nn1c2ccccc2F)CC(C)(C)C)C(=O)O
Chemical ID:
3987324
Name [?]:
1-(2-fluorophenyl)-3-neopentyl-5-propyl-pyrazole-4-carboxylic acid
SMILES [?]:
CCCc1c(c(nn1c2ccccc2F)CC(C)(C)C)C(=O)O
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C18H23FN2O2
All Atoms:23
Heavy Atoms:23
Chiral Atoms:0
ZAP Information [?]
Total:9.26654
Area:502.309
Solvation:-3.29118
Coulombic:-37.3413
Bond Count [?]
All:24
Single:18
Double:6
Rotors:6
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:318.386
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:4.99
LogP (Chemaxon):4.18

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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