Chemical ID: 5302347

CCOc1ccc(cc1)NC(=O)CSc2nnc(n2c3ccc(cc3)OC)c4cccc(c4)OC
Chemical ID:
5302347
Name [?]:
N-(4-ethoxyphenyl)-2-[[5-(3-methoxyphenyl)-4-(4-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide
SMILES [?]:
CCOc1ccc(cc1)NC(=O)CSc2nnc(n2c3ccc(cc3)OC)c4cccc(c4)OC
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C26H26N4O4S
All Atoms:35
Heavy Atoms:35
Chiral Atoms:0
ZAP Information [?]
Total:11.756
Area:742.388
Solvation:-6.80372
Coulombic:-54.5396
Bond Count [?]
All:38
Single:26
Double:12
Rotors:11
Chiral:0
Rigid Segments:9
Chemical Properties
Molecular Weight:490.575
H-Bond Donors:1
H-Bond Acceptors:5
XLogP:6.26
LogP (Chemaxon):4.29

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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