Gepotidacin HydrochlorideProduct ingredient for Gepotidacin
- Name
- Gepotidacin Hydrochloride
- Drug Entry
- Gepotidacin
Gepotidacin has been used in trials studying the treatment of Gonorrhea, Infections, Bacterial, and Infections, Respiratory Tract.
- Accession Number
- DBSALT002141
- Structure
Structure for Gepotidacin Hydrochloride (DBSALT002141)
- Synonyms
- Not Available
- UNII
- 30Z5B7ACV6
- CAS Number
- 1075235-46-9
- Weight
- Average: 484.99
Monoisotopic: 484.1989665 - Chemical Formula
- C24H29ClN6O3
- InChI Key
- DPAHPKBTWARMFG-FSRHSHDFSA-N
- InChI
- InChI=1S/C24H28N6O3.ClH/c31-22-4-3-20-24-29(22)15-19(30(24)23(32)13-27-20)14-28-7-5-17(6-8-28)25-11-18-10-16-2-1-9-33-21(16)12-26-18;/h3-4,10,12-13,17,19,25H,1-2,5-9,11,14-15H2;1H/t19-;/m1./s1
- IUPAC Name
- (3R)-3-({4-[({2H,3H,4H-pyrano[2,3-c]pyridin-6-yl}methyl)amino]piperidin-1-yl}methyl)-1,4,7-triazatricyclo[6.3.1.0^{4,12}]dodeca-6,8(12),9-triene-5,11-dione hydrochloride
- SMILES
- Cl.O=C1C=CC2=C3N1C[C@@H](CN1CCC(CC1)NCC1=CC4=C(OCCC4)C=N1)N3C(=O)C=N2
- External Links
- ChemSpider
- 34996206
- Predicted Properties
Property Value Source Water Solubility 0.311 mg/mL ALOGPS logP 0.97 ALOGPS logP 0.16 Chemaxon logS -3.2 ALOGPS pKa (Strongest Basic) 8.62 Chemaxon Physiological Charge 1 Chemaxon Hydrogen Acceptor Count 7 Chemaxon Hydrogen Donor Count 1 Chemaxon Polar Surface Area 90.37 Å2 Chemaxon Rotatable Bond Count 5 Chemaxon Refractivity 133.84 m3·mol-1 Chemaxon Polarizability 49.24 Å3 Chemaxon Number of Rings 6 Chemaxon Bioavailability 1 Chemaxon Rule of Five Yes Chemaxon Ghose Filter No Chemaxon Veber's Rule No Chemaxon MDDR-like Rule No Chemaxon