Chemical ID: 4796517

COc1cccc(c1)C=c2c(=O)n(c(=C(C#N)C(=O)Nc3cccc(c3)OC)s2)c4ccccc4
Chemical ID:
4796517
Name [?]:
N-(3-methoxyphenyl)-2-[5-[(3-methoxyphenyl)methylene]-4-oxo-3-phenyl-thiazolidin-2-ylidene]-3-nitrido-propanamide
SMILES [?]:
COc1cccc(c1)C=c2c(=O)n(c(=C(C#N)C(=O)Nc3cccc(c3)OC)s2)c4ccccc4
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C27H21N3O4S
All Atoms:35
Heavy Atoms:35
Chiral Atoms:0
ZAP Information [?]
Total:10.9393
Area:694.094
Solvation:-6.41303
Coulombic:-56.5509
Bond Count [?]
All:38
Single:24
Double:13
Rotors:7
Chiral:2
Rigid Segments:7
Chemical Properties
Molecular Weight:483.539
H-Bond Donors:1
H-Bond Acceptors:6
XLogP:5.17
LogP (Chemaxon):5.08

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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