F2801-0451
TL;DR: F2801-0451 (CAS 840469-64-9) is a chemical compound with molecular formula C22H27N3O2S and molecular weight 397.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-methoxy-1'-propyl-2-thiophen-2-ylspiro[1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine-5,4'-piperidine]
Also Known As: F2801-0451, 7-methoxy-1'-propyl-2-(thiophen-2-yl)-1,10b-dihydrospiro[benzo[e]pyrazolo[1,5-c][1,3]oxazine-5,4'-piperidine], 10'-methoxy-1-propyl-4'-(thiophen-2-yl)-8'-oxa-5',6'-diazaspiro[piperidine-4,7'-tricyclo[7.4.0.0^{2,6}]tridecane]-1'(9'),4',10',12'-tetraene, 7-methoxy-1'-propyl-2-thiophen-2-ylspiro[1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine-5,4'-piperidine], 10-methoxy-1'-propyl-4-(2-thienyl)spiro[8-oxa-5,6-diazatricyclo[7.4.0.0(2),]trideca-1(9),4,10,12-tetraene-7,4'-piperidine]
| Molecular Formula | C22H27N3O2S |
|---|---|
| Molecular Weight | 397.18 g/mol |
| LogP | 4.5023 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 397.1824 |
| Heavy Atoms | 28 |
| Complexity | 871.9119 |
Chemical Identifiers
| CAS Number | 840469-64-9 |
|---|---|
| SMILES | CCCN1CCC2(CC1)N3C(CC(=N3)C4=CC=CS4)C5=C(O2)C(=CC=C5)OC |
Product Overview
F2801-0451 (CAS 840469-64-9), with molecular formula C22H27N3O2S and molecular weight 397.18 g/mol. IUPAC: 7-methoxy-1'-propyl-2-thiophen-2-ylspiro[1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine-5,4'-piperidine].
Chemical Property Profile of F2801-0451
Property Insights of F2801-0451
The XLogP value of 4.5023 indicates that F2801-0451 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.3 Ų, F2801-0451 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, F2801-0451 has 0 hydrogen bond donor(s) and 6 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 F2801-0451?
The CAS number of F2801-0451 is 840469-64-9.
What is the molecular formula of F2801-0451?
The molecular formula of F2801-0451 is C22H27N3O2S.
What is the molecular weight of F2801-0451?
The molecular weight of F2801-0451 is 397.18 g/mol.
Where can I buy F2801-0451?
You can request a quote for F2801-0451 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F2801-0451?
Yes, KEHONG BIO provides custom synthesis services for F2801-0451 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.