Chemical ID: 5800321

CC(C)Oc1ccc(cc1C=C2C(=O)N(C(=Nc3ccccc3)S2)c4ccccc4)Br
Chemical ID:
5800321
Name [?]:
5-[(5-bromo-2-isopropoxy-phenyl)methylene]-3-phenyl-2-phenylimino-thiazolidin-4-one
SMILES [?]:
CC(C)Oc1ccc(cc1C=C2C(=O)N(C(=Nc3ccccc3)S2)c4ccccc4)Br
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C25H21BrN2O2S
All Atoms:31
Heavy Atoms:31
Chiral Atoms:0
ZAP Information [?]
Total:12.4149
Area:615.59
Solvation:-2.9748
Coulombic:-34.4933
Bond Count [?]
All:34
Single:22
Double:12
Rotors:5
Chiral:2
Rigid Segments:5
Chemical Properties
Molecular Weight:493.417
H-Bond Donors:0
H-Bond Acceptors:4
XLogP:6.4
LogP (Chemaxon):7.57

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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