Metabolite 10-Hydroxycarbazepine
- Name
- 10-Hydroxycarbazepine
- Description
- Not Available
- Structure
Structure for 10-Hydroxycarbazepine
- Synonyms
- Not Available
- UNII
- Not Available
- CAS number
- Not Available
- Weight
- Average: 254.2839
Monoisotopic: 254.105527702 - Chemical Formula
- C15H14N2O2
- InChI Key
- BMPDWHIDQYTSHX-UHFFFAOYSA-N
- InChI
- InChI=1S/C15H14N2O2/c16-15(19)17-12-7-3-1-5-10(12)9-14(18)11-6-2-4-8-13(11)17/h1-8,14,18H,9H2,(H2,16,19)
- IUPAC Name
- 9-hydroxy-2-azatricyclo[9.4.0.0³,⁸]pentadeca-1(15),3,5,7,11,13-hexaene-2-carboxamide
- SMILES
- NC(=O)N1C2=CC=CC=C2CC(O)C2=CC=CC=C12
- Reactions
- External Links
- Human Metabolome Database
- HMDB0060676
- KEGG Compound
- C07493
- ChemSpider
- 102704
- BindingDB
- 50330859
- ChEBI
- 701
- ChEMBL
- CHEMBL1067
- Predicted Properties
Property Value Source Water Solubility 0.554 mg/mL ALOGPS logP 1.26 ALOGPS logP 1.73 ChemAxon logS -2.7 ALOGPS pKa (Strongest Acidic) 14.1 ChemAxon pKa (Strongest Basic) -3.2 ChemAxon Physiological Charge 0 ChemAxon Hydrogen Acceptor Count 2 ChemAxon Hydrogen Donor Count 2 ChemAxon Polar Surface Area 66.56 Å2 ChemAxon Rotatable Bond Count 0 ChemAxon Refractivity 72.29 m3·mol-1 ChemAxon Polarizability 26.31 Å3 ChemAxon Number of Rings 3 ChemAxon Bioavailability 1 ChemAxon Rule of Five Yes ChemAxon Ghose Filter Yes ChemAxon Veber's Rule No ChemAxon MDDR-like Rule No ChemAxon