AB01314798-01
TL;DR: AB01314798-01 (CAS 840462-79-5) is a chemical compound with molecular formula C25H29N3O4 and molecular weight 435.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2,3-dihydro-1,4-benzodioxin-6-yl)-1'-ethyl-7-methoxyspiro[1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine-5,4'-piperidine]
Also Known As: AB01314798-01, 2'-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-ethyl-7'-methoxy-1',10b'-dihydrospiro[piperidine-4,5'-pyrazolo[1,5-c][1,3]benzoxazine], 2-(2,3-dihydro-1,4-benzodioxin-6-yl)-1'-ethyl-7-methoxyspiro[1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine-5,4'-piperidine], 2-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)-1'-ethyl-7-methoxy-1,10b-dihydrospiro[benzo[e]pyrazolo[1,5-c][1,3]oxazine-5,4'-piperidine]
| Molecular Formula | C25H29N3O4 |
|---|---|
| Molecular Weight | 435.22 g/mol |
| LogP | 3.8219 |
| Topological Polar Surface Area | 55.76 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 435.21582 |
| Heavy Atoms | 32 |
| Complexity | 1061.1477 |
Chemical Identifiers
| CAS Number | 840462-79-5 |
|---|---|
| SMILES | CCN1CCC2(CC1)N3C(CC(=N3)C4=CC5=C(C=C4)OCCO5)C6=C(O2)C(=CC=C6)OC |
Product Overview
AB01314798-01 (CAS 840462-79-5), with molecular formula C25H29N3O4 and molecular weight 435.22 g/mol. IUPAC: 2-(2,3-dihydro-1,4-benzodioxin-6-yl)-1'-ethyl-7-methoxyspiro[1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine-5,4'-piperidine].
Chemical Property Profile of AB01314798-01
Property Insights of AB01314798-01
The XLogP value of 3.8219 indicates that AB01314798-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.76 Ų, AB01314798-01 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AB01314798-01 has 0 hydrogen bond donor(s) and 7 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 AB01314798-01?
The CAS number of AB01314798-01 is 840462-79-5.
What is the molecular formula of AB01314798-01?
The molecular formula of AB01314798-01 is C25H29N3O4.
What is the molecular weight of AB01314798-01?
The molecular weight of AB01314798-01 is 435.22 g/mol.
Where can I buy AB01314798-01?
You can request a quote for AB01314798-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB01314798-01?
Yes, KEHONG BIO provides custom synthesis services for AB01314798-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.