AS-871/43476762
TL;DR: AS-871/43476762 (CAS 374921-75-2) is a chemical compound with molecular formula C21H22BrN3O and molecular weight 411.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
9-bromo-1'-methyl-2-phenylspiro[1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine-5,4'-piperidine]
Also Known As: AS-871/43476762, 9-bromo-1'-methyl-2-phenylspiro[1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine-5,4'-piperidine], 12'-bromo-1-methyl-4'-phenyl-8'-oxa-5',6'-diazaspiro[piperidine-4,7'-tricyclo[7.4.0.0^{2,6}]tridecane]-1'(9'),4',10',12'-tetraene, F3077-0626, 9-bromo-1'-methyl-2-phenyl-1,10b-dihydrospiro[benzo[e]pyrazolo[1,5-c][1,3]oxazine-5,4'-piperidine]
| Molecular Formula | C21H22BrN3O |
|---|---|
| Molecular Weight | 411.09 g/mol |
| LogP | 4.4145 |
| Topological Polar Surface Area | 28.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 411.09464 |
| Heavy Atoms | 26 |
| Complexity | 858.8148 |
Chemical Identifiers
| CAS Number | 374921-75-2 |
|---|---|
| SMILES | CN1CCC2(CC1)N3C(CC(=N3)C4=CC=CC=C4)C5=C(O2)C=CC(=C5)Br |
Product Overview
AS-871/43476762 (CAS 374921-75-2), with molecular formula C21H22BrN3O and molecular weight 411.09 g/mol. IUPAC: 9-bromo-1'-methyl-2-phenylspiro[1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine-5,4'-piperidine].
Chemical Property Profile of AS-871/43476762
Property Insights of AS-871/43476762
The XLogP value of 4.4145 indicates that AS-871/43476762 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 28.07 Ų, AS-871/43476762 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AS-871/43476762 has 0 hydrogen bond donor(s) and 4 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 AS-871/43476762?
The CAS number of AS-871/43476762 is 374921-75-2.
What is the molecular formula of AS-871/43476762?
The molecular formula of AS-871/43476762 is C21H22BrN3O.
What is the molecular weight of AS-871/43476762?
The molecular weight of AS-871/43476762 is 411.09 g/mol.
Where can I buy AS-871/43476762?
You can request a quote for AS-871/43476762 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AS-871/43476762?
Yes, KEHONG BIO provides custom synthesis services for AS-871/43476762 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.