A3545/0150241
TL;DR: A3545/0150241 (CAS 627889-54-7) is a chemical compound with molecular formula C21H15Br2N3O and molecular weight 482.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7,9-dibromo-2-phenyl-5-pyridin-3-yl-5,10b-dihydro-1H-pyrazolo[1,5-c][1,3]benzoxazine
Also Known As: A3545/0150241, 7,9-dibromo-2-phenyl-5-(pyridin-3-yl)-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine, 7,9-DIBROMO-2-PHENYL-5-(3-PYRIDYL)-1,10B-DIHYDROPYRAZOLO[1,5-C][1,3]BENZOXAZINE, 7,9-dibromo-2-phenyl-5-pyridin-3-yl-5,10b-dihydro-1H-pyrazolo[1,5-c][1,3]benzoxazine, 7,9-dibromo-2-phenyl-5-(pyridin-3-yl)-5,10b-dihydro-1H-benzo[e]pyrazolo[1,5-c][1,3]oxazine
| Molecular Formula | C21H15Br2N3O |
|---|---|
| Molecular Weight | 482.96 g/mol |
| LogP | 5.8489 |
| Topological Polar Surface Area | 37.72 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 482.9582 |
| Heavy Atoms | 27 |
| Complexity | 1024.3566 |
Chemical Identifiers
| CAS Number | 627889-54-7 |
|---|---|
| SMILES | C1C2C3=C(C(=CC(=C3)Br)Br)OC(N2N=C1C4=CC=CC=C4)C5=CN=CC=C5 |
Product Overview
A3545/0150241 (CAS 627889-54-7), with molecular formula C21H15Br2N3O and molecular weight 482.96 g/mol. IUPAC: 7,9-dibromo-2-phenyl-5-pyridin-3-yl-5,10b-dihydro-1H-pyrazolo[1,5-c][1,3]benzoxazine.
Chemical Property Profile of A3545/0150241
Property Insights of A3545/0150241
The XLogP value of 5.8489 indicates that A3545/0150241 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.72 Ų, A3545/0150241 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, A3545/0150241 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 A3545/0150241?
The CAS number of A3545/0150241 is 627889-54-7.
What is the molecular formula of A3545/0150241?
The molecular formula of A3545/0150241 is C21H15Br2N3O.
What is the molecular weight of A3545/0150241?
The molecular weight of A3545/0150241 is 482.96 g/mol.
Where can I buy A3545/0150241?
You can request a quote for A3545/0150241 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A3545/0150241?
Yes, KEHONG BIO provides custom synthesis services for A3545/0150241 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.