Chemical ID: 3846547

CN(C)CCCn1c(nnc1SCC(=O)Nc2cccc(c2)Cl)c3ccncc3
Chemical ID:
3846547
Name [?]:
N-(3-chlorophenyl)-2-[[4-(3-dimethylaminopropyl)-5-(4-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide
SMILES [?]:
CN(C)CCCn1c(nnc1SCC(=O)Nc2cccc(c2)Cl)c3ccncc3
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C20H23ClN6OS
All Atoms:29
Heavy Atoms:29
Chiral Atoms:0
ZAP Information [?]
Total:12.6505
Area:672.152
Solvation:-4.15328
Coulombic:-41.8863
Bond Count [?]
All:31
Single:22
Double:9
Rotors:10
Chiral:0
Rigid Segments:7
Chemical Properties
Molecular Weight:430.955
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:4.11
LogP (Chemaxon):2.53

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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