Chemical ID: 4483923

CCn1c(nnc1SCC(=O)Nc2nc3ccccc3s2)CC(=O)Nc4ccc(cc4)C
Chemical ID:
4483923
Name [?]:
N-benzothiazol-2-yl-2-[[4-ethyl-5-(p-tolylcarbamoylmethyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide
SMILES [?]:
CCn1c(nnc1SCC(=O)Nc2nc3ccccc3s2)CC(=O)Nc4ccc(cc4)C
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C22H22N6O2S2
All Atoms:32
Heavy Atoms:32
Chiral Atoms:0
ZAP Information [?]
Total:12.2669
Area:708.839
Solvation:-5.45411
Coulombic:-56.299
Bond Count [?]
All:35
Single:24
Double:11
Rotors:10
Chiral:0
Rigid Segments:7
Chemical Properties
Molecular Weight:466.581
H-Bond Donors:2
H-Bond Acceptors:4
XLogP:4.14
LogP (Chemaxon):4.53

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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