Metabolite Carboxy tedizolid
- Name
- Carboxy tedizolid
- Description
- Not Available
- Structure
- Synonyms
- Not Available
- UNII
- G5ADH118ED
- CAS number
- Not Available
- Weight
- Average: 384.327
Monoisotopic: 384.098231086 - Chemical Formula
- C17H13FN6O4
- InChI Key
- ZVOALCPUWJGRDY-CQSZACIVSA-N
- InChI
- InChI=1S/C17H13FN6O4/c1-23-21-15(20-22-23)13-5-2-9(7-19-13)11-4-3-10(6-12(11)18)24-8-14(16(25)26)28-17(24)27/h2-7,14H,8H2,1H3,(H,25,26)/t14-/m1/s1
- IUPAC Name
- (5R)-3-{3-fluoro-4-[6-(2-methyl-2H-1,2,3,4-tetrazol-5-yl)pyridin-3-yl]phenyl}-2-oxo-1,3-oxazolidine-5-carboxylic acid
- SMILES
- CN1N=NC(=N1)C1=NC=C(C=C1)C1=C(F)C=C(C=C1)N1C[C@@H](OC1=O)C(O)=O
- Reactions
- Tedizolid phosphate Tedizolid
- Tedizolid Tedizolid sulphate
- Tedizolid sulphate Desmethyl tedizolid sulphate
- Tedizolid Desmethyl tedizolid
- Desmethyl tedizolid Desmethyl tedizolid sulphate
- Tedizolid Carboxy tedizolid
- Carboxy tedizolid Ring-opened tedizolid metabolite
- Tedizolid Ring-opened tedizolid metabolite
- Tedizolid Tedizolid sulphate
- Tedizolid phosphate Tedizolid
- Spectra
- Chromatographic Properties
Collision Cross Sections (CCS)
Adduct CCS Value (Å2) Source type Source [M-H]- 187.29506 predictedDeepCCS 1.0 (2019) [M+H]+ 189.65306 predictedDeepCCS 1.0 (2019) [M+Na]+ 196.1611 predictedDeepCCS 1.0 (2019) - External Links
- ChemSpider
- 52084197
- Predicted Properties
Property Value Source Water Solubility 0.222 mg/mL ALOGPS logP 1.13 ALOGPS logP 2.45 Chemaxon logS -3.2 ALOGPS pKa (Strongest Acidic) 3.27 Chemaxon pKa (Strongest Basic) -1.7 Chemaxon Physiological Charge -1 Chemaxon Hydrogen Acceptor Count 8 Chemaxon Hydrogen Donor Count 1 Chemaxon Polar Surface Area 123.33 Å2 Chemaxon Rotatable Bond Count 4 Chemaxon Refractivity 114.92 m3·mol-1 Chemaxon Polarizability 36.83 Å3 Chemaxon Number of Rings 4 Chemaxon Bioavailability 1 Chemaxon Rule of Five Yes Chemaxon Ghose Filter Yes Chemaxon Veber's Rule No Chemaxon MDDR-like Rule No Chemaxon