Chemical ID: 4490610

COc1ccc(cc1OC)c2csc(n2)NC(=S)NC(=O)CC34CC5CC(C3)CC(C5)C4
Chemical ID:
4490610
Name [?]:
2-(1-adamantyl)-N-[[4-(3,4-dimethoxyphenyl)thiazol-2-yl]thiocarbamoyl]acetamide
SMILES [?]:
COc1ccc(cc1OC)c2csc(n2)NC(=S)NC(=O)CC34CC5CC(C3)CC(C5)C4
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C24H29N3O3S2
All Atoms:32
Heavy Atoms:32
Chiral Atoms:0
ZAP Information [?]
Total:10.6276
Area:668.146
Solvation:-6.0761
Coulombic:-52.3546
Bond Count [?]
All:36
Single:29
Double:7
Rotors:9
Chiral:0
Rigid Segments:7
Chemical Properties
Molecular Weight:471.637
H-Bond Donors:2
H-Bond Acceptors:5
XLogP:6.27
LogP (Chemaxon):5.13

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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