AB01280872-01
TL;DR: AB01280872-01 (CAS 849827-75-4) is a chemical compound with molecular formula C22H24ClN3O3S and molecular weight 445.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-chlorophenyl)-9-methyl-1'-methylsulfonylspiro[1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine-5,4'-piperidine]
Also Known As: AB01280872-01, 2'-(2-chlorophenyl)-9'-methyl-1-(methylsulfonyl)-1',10b'-dihydrospiro[piperidine-4,5'-pyrazolo[1,5-c][1,3]benzoxazine], 2-(2-chlorophenyl)-9-methyl-1'-(methylsulfonyl)-1,10b-dihydrospiro[benzo[e]pyrazolo[1,5-c][1,3]oxazine-5,4'-piperidine], 2-(2-chlorophenyl)-9-methyl-1'-methylsulfonylspiro[1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine-5,4'-piperidine]
| Molecular Formula | C22H24ClN3O3S |
|---|---|
| Molecular Weight | 445.12 g/mol |
| LogP | 3.94362 |
| Topological Polar Surface Area | 62.21 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 445.12268 |
| Heavy Atoms | 30 |
| Complexity | 1140.0668 |
Chemical Identifiers
| CAS Number | 849827-75-4 |
|---|---|
| SMILES | CC1=CC2=C(C=C1)OC3(CCN(CC3)S(=O)(=O)C)N4C2CC(=N4)C5=CC=CC=C5Cl |
Product Overview
AB01280872-01 (CAS 849827-75-4), with molecular formula C22H24ClN3O3S and molecular weight 445.12 g/mol. IUPAC: 2-(2-chlorophenyl)-9-methyl-1'-methylsulfonylspiro[1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine-5,4'-piperidine].
Chemical Property Profile of AB01280872-01
Property Insights of AB01280872-01
The XLogP value of 3.94362 indicates that AB01280872-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 62.21 Ų falls within the moderate polarity range, balancing permeability and solubility for AB01280872-01. Following Lipinski's Rule of Five, AB01280872-01 has 0 hydrogen bond donor(s) and 5 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 AB01280872-01?
The CAS number of AB01280872-01 is 849827-75-4.
What is the molecular formula of AB01280872-01?
The molecular formula of AB01280872-01 is C22H24ClN3O3S.
What is the molecular weight of AB01280872-01?
The molecular weight of AB01280872-01 is 445.12 g/mol.
Where can I buy AB01280872-01?
You can request a quote for AB01280872-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB01280872-01?
Yes, KEHONG BIO provides custom synthesis services for AB01280872-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.