Chemical ID: 5551021

CN1CCN(CC1)C(=S)c2ccc(cc2)OCC(=O)NCc3ccccc3
Chemical ID:
5551021
Name [?]:
N-benzyl-2-[4-(4-methylpiperazin-1-yl)carbothioylphenoxy]-acetamide
SMILES [?]:
CN1CCN(CC1)C(=S)c2ccc(cc2)OCC(=O)NCc3ccccc3
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C21H25N3O2S
All Atoms:27
Heavy Atoms:27
Chiral Atoms:0
ZAP Information [?]
Total:11.0382
Area:627.746
Solvation:-4.65549
Coulombic:-42.4048
Bond Count [?]
All:29
Single:21
Double:8
Rotors:8
Chiral:0
Rigid Segments:7
Chemical Properties
Molecular Weight:383.508
H-Bond Donors:1
H-Bond Acceptors:5
XLogP:2.94
LogP (Chemaxon):2.17

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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