Chemical ID: 4418465

Cc1cc(c(n1C2CC2)C)C=C3C(=O)NC(=S)N(C3=O)c4cccc(c4)OC
Chemical ID:
4418465
Name [?]:
5-[(1-cyclopropyl-2,5-dimethyl-pyrrol-3-yl)methylene]-1-(3-methoxyphenyl)-2-thioxo-hexahydropyrimidine-4,6-dione
SMILES [?]:
Cc1cc(c(n1C2CC2)C)C=C3C(=O)NC(=S)N(C3=O)c4cccc(c4)OC
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C21H21N3O3S
All Atoms:28
Heavy Atoms:28
Chiral Atoms:0
ZAP Information [?]
Total:10.6023
Area:590.478
Solvation:-4.15969
Coulombic:-49.5098
Bond Count [?]
All:31
Single:22
Double:9
Rotors:4
Chiral:1
Rigid Segments:5
Chemical Properties
Molecular Weight:395.476
H-Bond Donors:1
H-Bond Acceptors:5
XLogP:2.6
LogP (Chemaxon):2.78

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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