Chemical ID: 6804602

COc1ccc(cc1)C2C(=O)N(CC(=O)N2Cc3cccs3)C4CCCCC4
Chemical ID:
6804602
Name [?]:
1-cyclohexyl-3-(4-methoxyphenyl)-4-(2-thienylmethyl)piperazine-2,5-dione
SMILES [?]:
COc1ccc(cc1)C2C(=O)N(CC(=O)N2Cc3cccs3)C4CCCCC4
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C22H26N2O3S
All Atoms:54
Heavy Atoms:28
Chiral Atoms:1
ZAP Information [?]
Total:10.7448
Area:589.435
Solvation:-3.99108
Coulombic:-43.6481
Bond Count [?]
All:31
Single:24
Double:7
Rotors:5
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:398.52
H-Bond Donors:0
H-Bond Acceptors:5
XLogP:2.72
LogP (Chemaxon):2.84

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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