Chemical ID: 3847435

CCOC(=O)c1cccc(c1)NC(=O)CSc2nnc(n2C)C
Chemical ID:
3847435
Name [?]:
ethyl 3-[2-[(4,5-dimethyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]aminobenzoate
SMILES [?]:
CCOC(=O)c1cccc(c1)NC(=O)CSc2nnc(n2C)C
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C15H18N4O3S
All Atoms:23
Heavy Atoms:23
Chiral Atoms:0
ZAP Information [?]
Total:10.3228
Area:563.797
Solvation:-3.77208
Coulombic:-50.3156
Bond Count [?]
All:24
Single:17
Double:7
Rotors:8
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:334.395
H-Bond Donors:1
H-Bond Acceptors:4
XLogP:3.17
LogP (Chemaxon):1.18

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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