RefChem:544876
TL;DR: RefChem:544876 (CAS 477333-59-8) is a chemical compound with molecular formula C21H14Cl2FN3O and molecular weight 413.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7,9-dichloro-2-(4-fluorophenyl)-5-pyridin-4-yl-5,10b-dihydro-1H-pyrazolo[1,5-c][1,3]benzoxazine
Also Known As: Salor-int l248452-1ea, 7,9-DICHLORO-2-(4-FLUOROPHENYL)-5-(4-PYRIDINYL)-1,10B-DIHYDROPYRAZOLO[1,5-C][1,3]BENZOXAZINE, 7,9-Dichloro-2-(4-fluorophenyl)-5-(pyridin-4-yl)-5,10b-dihydro-1H-benzo[e]pyrazolo[1,5-c][1,3]oxazine, 649-962-9, 7,9-DICHLORO-2-(4-FLUOROPHENYL)-5-(4-PYRIDINYL)-1,10B-DIHYDROPYRAZOLO(1,5-C)(1,3)BENZOXAZINE
| Molecular Formula | C21H14Cl2FN3O |
|---|---|
| Molecular Weight | 413.05 g/mol |
| LogP | 5.7698 |
| Topological Polar Surface Area | 37.72 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 413.0498 |
| Heavy Atoms | 28 |
| Complexity | 1073.0138 |
Chemical Identifiers
| CAS Number | 477333-59-8 |
|---|---|
| SMILES | C1C2C3=C(C(=CC(=C3)Cl)Cl)OC(N2N=C1C4=CC=C(C=C4)F)C5=CC=NC=C5 |
Product Overview
RefChem:544876 (CAS 477333-59-8), with molecular formula C21H14Cl2FN3O and molecular weight 413.05 g/mol. IUPAC: 7,9-dichloro-2-(4-fluorophenyl)-5-pyridin-4-yl-5,10b-dihydro-1H-pyrazolo[1,5-c][1,3]benzoxazine.
Chemical Property Profile of RefChem:544876
Property Insights of RefChem:544876
The XLogP value of 5.7698 indicates that RefChem:544876 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.72 Ų, RefChem:544876 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:544876 has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:544876?
The CAS number of RefChem:544876 is 477333-59-8.
What is the molecular formula of RefChem:544876?
The molecular formula of RefChem:544876 is C21H14Cl2FN3O.
What is the molecular weight of RefChem:544876?
The molecular weight of RefChem:544876 is 413.05 g/mol.
Where can I buy RefChem:544876?
You can request a quote for RefChem:544876 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:544876?
Yes, KEHONG BIO provides custom synthesis services for RefChem:544876 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.