Chemical ID: 5885124

CCCCc1ccc(cc1)C(=O)N(CCCOC)CC(=O)Nc2cc(nn2c3ccccc3Cl)C(C)(C)C
Chemical ID:
5885124
Name [?]:
4-butyl-N-[[2-(2-chlorophenyl)-5-tert-butyl-pyrazol-3-yl]carbamoylmethyl]-N-(3-methoxypropyl)benzamide
SMILES [?]:
CCCCc1ccc(cc1)C(=O)N(CCCOC)CC(=O)Nc2cc(nn2c3ccccc3Cl)C(C)(C)C
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C30H39ClN4O3
All Atoms:38
Heavy Atoms:38
Chiral Atoms:0
ZAP Information [?]
Total:15.4469
Area:839.112
Solvation:-5.53092
Coulombic:-53.5671
Bond Count [?]
All:40
Single:30
Double:10
Rotors:15
Chiral:0
Rigid Segments:11
Chemical Properties
Molecular Weight:539.109
H-Bond Donors:1
H-Bond Acceptors:5
XLogP:6.66
LogP (Chemaxon):6.26

Name Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

ChemicalMix SourceExternal IDDescriptorValue

Experimental Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue

Descriptor Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue