Chemical ID: 5585126

Cn1c(nnc1SCC(=O)Nc2ccc3c(c2)CCC3)COc4ccc(cc4)Cl
Chemical ID:
5585126
Name [?]:
2-[[5-[(4-chlorophenoxy)methyl]-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-N-indan-5-yl-acetamide
SMILES [?]:
Cn1c(nnc1SCC(=O)Nc2ccc3c(c2)CCC3)COc4ccc(cc4)Cl
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C21H21ClN4O2S
All Atoms:29
Heavy Atoms:29
Chiral Atoms:0
ZAP Information [?]
Total:12.2493
Area:669.435
Solvation:-4.48656
Coulombic:-40.3855
Bond Count [?]
All:32
Single:23
Double:9
Rotors:8
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:428.936
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:5.73
LogP (Chemaxon):4.13

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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