Chemical ID: 4363911

CC(C)(C)c1ccc(cc1)OCCn2cc(c3c2cccc3)C=C4C(=O)NC(=N)S4
Chemical ID:
4363911
Name [?]:
2-imino-5-[[1-[2-(4-tert-butylphenoxy)ethyl]indol-3-yl]methylene]thiazolidin-4-one
SMILES [?]:
CC(C)(C)c1ccc(cc1)OCCn2cc(c3c2cccc3)C=C4C(=O)NC(=N)S4
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C24H25N3O2S
All Atoms:30
Heavy Atoms:30
Chiral Atoms:0
ZAP Information [?]
Total:12.9313
Area:662.759
Solvation:-3.63766
Coulombic:-49.838
Bond Count [?]
All:33
Single:23
Double:10
Rotors:6
Chiral:2
Rigid Segments:5
Chemical Properties
Molecular Weight:419.54
H-Bond Donors:2
H-Bond Acceptors:4
XLogP:5.76
LogP (Chemaxon):5.89

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