Chemical ID: 5671276

c1ccc(c(c1)OCc2nnc(n2C3CC3)SCC(=O)Nc4c(cc(cn4)Cl)Cl)Cl
Chemical ID:
5671276
Name [?]:
2-[[5-[(2-chlorophenoxy)methyl]-4-cyclopropyl-1,2,4-triazol-3-yl]sulfanyl]-N-(3,5-dichloro-2-pyridyl)-acetamide
SMILES [?]:
c1ccc(c(c1)OCc2nnc(n2C3CC3)SCC(=O)Nc4c(cc(cn4)Cl)Cl)Cl
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C19H16Cl3N5O2S
All Atoms:30
Heavy Atoms:30
Chiral Atoms:0
ZAP Information [?]
Total:12.4714
Area:707.323
Solvation:-5.21166
Coulombic:-45.1102
Bond Count [?]
All:33
Single:24
Double:9
Rotors:9
Chiral:0
Rigid Segments:7
Chemical Properties
Molecular Weight:484.787
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:6.1
LogP (Chemaxon):3.48

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