Chemical ID: 5367266

CCC(=O)N1CCN(CC1)c2ccc(cc2NC(=O)CSc3ccc(cc3)Cl)Cl
Chemical ID:
5367266
Name [?]:
2-(4-chlorophenyl)sulfanyl-N-[5-chloro-2-(4-propanoylpiperazin-1-yl)-phenyl]-acetamide
SMILES [?]:
CCC(=O)N1CCN(CC1)c2ccc(cc2NC(=O)CSc3ccc(cc3)Cl)Cl
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C21H23Cl2N3O2S
All Atoms:29
Heavy Atoms:29
Chiral Atoms:0
ZAP Information [?]
Total:12.8651
Area:687.556
Solvation:-4.32384
Coulombic:-43.7663
Bond Count [?]
All:31
Single:23
Double:8
Rotors:8
Chiral:0
Rigid Segments:7
Chemical Properties
Molecular Weight:452.398
H-Bond Donors:1
H-Bond Acceptors:5
XLogP:4.38
LogP (Chemaxon):4.49

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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