Chemical ID: 5244263

CN1CCOc2c1cnn(c2=O)CCO
Chemical ID:
5244263
Name [?]:
3-(2-hydroxyethyl)-7-methyl-10-oxa-3,4,7-triazabicyclo[4.4.0]deca-4,11-dien-2-one
SMILES [?]:
CN1CCOc2c1cnn(c2=O)CCO
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C9H13N3O3
All Atoms:15
Heavy Atoms:15
Chiral Atoms:1
ZAP Information [?]
Total:4.5958
Area:362.333
Solvation:-4.46253
Coulombic:-46.5835
Bond Count [?]
All:16
Single:13
Double:3
Rotors:2
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:211.218
H-Bond Donors:1
H-Bond Acceptors:4
XLogP:0.05
LogP (Chemaxon):-0.8

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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