Chemical ID: 3898472

CCc1c(nc(nc1O)SCc2ccccc2)C
Chemical ID:
3898472
Name [?]:
2-benzylsulfanyl-5-ethyl-6-methyl-pyrimidin-4-ol
SMILES [?]:
CCc1c(nc(nc1O)SCc2ccccc2)C
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C14H16N2OS
All Atoms:18
Heavy Atoms:18
Chiral Atoms:0
ZAP Information [?]
Total:9.45103
Area:459.816
Solvation:-2.04438
Coulombic:-30.5056
Bond Count [?]
All:19
Single:13
Double:6
Rotors:4
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:260.356
H-Bond Donors:1
H-Bond Acceptors:1
XLogP:3.33
LogP (Chemaxon):4.37

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