Moxifloxacin Impurity 3
TL;DR: Moxifloxacin Impurity 3 (CAS 959347-97-8) is a chemical compound with molecular formula C21H25N3O4 and molecular weight 383.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-[(4aS,7aS)-1,2,3,4,4a,5,7,7a-octahydropyrrolo[3,4-b]pyridin-6-yl]-1-cyclopropyl-8-methoxy-4-oxoquinoline-3-carboxylic acid
Also Known As: Moxifloxacin Impurity 3, Moxifloxacin Impurity 20, Moxifloxacin Impurity 20 HCl, 1-cyclopropyl-1,4-dihydro-8-methoxy-7-[(4aS,7aS)-octahydro-6H-pyrrolo[3,4-b]pyridin-6-yl]-4-oxo-3-quinolinecarboxylic acid, 1-cyclopropyl-7-((4aS,7aS)-hexahydro-1H-pyrrolo[3,4-b]pyridin-6(2H)-yl)-8-methoxy-4-oxo-1,4-dihydroquinoline-3-carboxylic acid
| Molecular Formula | C21H25N3O4 |
|---|---|
| Molecular Weight | 383.18 g/mol |
| LogP | 0.5 |
| Topological Polar Surface Area | 82.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 383.1845 |
| Heavy Atoms | 28 |
| Complexity | 691.0 |
Chemical Identifiers
| CAS Number | 959347-97-8 |
|---|---|
| SMILES | COC1=C(C=CC2=C1N(C=C(C2=O)C(=O)O)C3CC3)N4C[C@@H]5CCCN[C@@H]5C4 |
| InChIKey | BHEIRUWTKHGJOV-BLLLJJGKSA-N |
Product Overview
Moxifloxacin Impurity 3 (CAS 959347-97-8), with molecular formula C21H25N3O4 and molecular weight 383.18 g/mol. IUPAC: 7-[(4aS,7aS)-1,2,3,4,4a,5,7,7a-octahydropyrrolo[3,4-b]pyridin-6-yl]-1-cyclopropyl-8-methoxy-4-oxoquinoline-3-carboxylic acid.
Chemical Property Profile of Moxifloxacin Impurity 3
Property Insights of Moxifloxacin Impurity 3
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Moxifloxacin Impurity 3. The TPSA of 82.1 Ų falls within the moderate polarity range, balancing permeability and solubility for Moxifloxacin Impurity 3. Following Lipinski's Rule of Five, Moxifloxacin Impurity 3 has 2 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Moxifloxacin Impurity 3?
The CAS number of Moxifloxacin Impurity 3 is 959347-97-8.
What is the molecular formula of Moxifloxacin Impurity 3?
The molecular formula of Moxifloxacin Impurity 3 is C21H25N3O4.
What is the molecular weight of Moxifloxacin Impurity 3?
The molecular weight of Moxifloxacin Impurity 3 is 383.18 g/mol.
Where can I buy Moxifloxacin Impurity 3?
You can request a quote for Moxifloxacin Impurity 3 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Moxifloxacin Impurity 3?
Yes, KEHONG BIO provides custom synthesis services for Moxifloxacin Impurity 3 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.