Chemical ID: 4549182

CCCC(=O)N1CCN(CC1)c2ccc(cc2)NC(=O)CSc3ccc(cc3)Cl
Chemical ID:
4549182
Name [?]:
N-[4-(4-butanoylpiperazin-1-yl)phenyl]-2-(4-chlorophenyl)sulfanyl-acetamide
SMILES [?]:
CCCC(=O)N1CCN(CC1)c2ccc(cc2)NC(=O)CSc3ccc(cc3)Cl
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C22H26ClN3O2S
All Atoms:29
Heavy Atoms:29
Chiral Atoms:0
ZAP Information [?]
Total:12.351
Area:684.275
Solvation:-4.75584
Coulombic:-43.0082
Bond Count [?]
All:31
Single:23
Double:8
Rotors:9
Chiral:0
Rigid Segments:7
Chemical Properties
Molecular Weight:431.98
H-Bond Donors:1
H-Bond Acceptors:5
XLogP:4.32
LogP (Chemaxon):4.37

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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