Chemical ID: 5389245

COc1ccc(cc1)n2c(nnn2)SCC(=O)Nc3ccc(c(c3)OC)OC
Chemical ID:
5389245
Name [?]:
N-(3,4-dimethoxyphenyl)-2-[1-(4-methoxyphenyl)tetrazol-5-yl]sulfanyl-acetamide
SMILES [?]:
COc1ccc(cc1)n2c(nnn2)SCC(=O)Nc3ccc(c(c3)OC)OC
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C18H19N5O4S
All Atoms:28
Heavy Atoms:28
Chiral Atoms:0
ZAP Information [?]
Total:8.18307
Area:623.298
Solvation:-7.39937
Coulombic:-46.4284
Bond Count [?]
All:30
Single:21
Double:9
Rotors:9
Chiral:0
Rigid Segments:8
Chemical Properties
Molecular Weight:401.441
H-Bond Donors:1
H-Bond Acceptors:5
XLogP:1.28
LogP (Chemaxon):2.49

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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