AB01291767-01
TL;DR: AB01291767-01 (CAS 896841-94-4) is a chemical compound with molecular formula C22H25N7S and molecular weight 419.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
13-benzyl-8-(2-methylpiperidin-1-yl)-16-thia-2,3,4,5,7,13-hexazatetracyclo[7.7.0.02,6.010,15]hexadeca-1(9),3,5,7,10(15)-pentaene
Also Known As: AB01291767-01, 8-benzyl-5-(2-methylpiperidin-1-yl)-6,7,8,9-tetrahydropyrido[4',3':4,5]thieno[3,2-e]tetrazolo[1,5-a]pyrimidine
| Molecular Formula | C22H25N7S |
|---|---|
| Molecular Weight | 419.19 g/mol |
| LogP | 3.6711 |
| Topological Polar Surface Area | 62.45 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 419.1892 |
| Heavy Atoms | 30 |
| Complexity | 1198.6229 |
Chemical Identifiers
| CAS Number | 896841-94-4 |
|---|---|
| SMILES | CC1CCCCN1C2=NC3=NN=NN3C4=C2C5=C(S4)CN(CC5)CC6=CC=CC=C6 |
Product Overview
AB01291767-01 (CAS 896841-94-4), with molecular formula C22H25N7S and molecular weight 419.19 g/mol. IUPAC: 13-benzyl-8-(2-methylpiperidin-1-yl)-16-thia-2,3,4,5,7,13-hexazatetracyclo[7.7.0.02,6.010,15]hexadeca-1(9),3,5,7,10(15)-pentaene.
Chemical Property Profile of AB01291767-01
Property Insights of AB01291767-01
The XLogP value of 3.6711 indicates that AB01291767-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 62.45 Ų falls within the moderate polarity range, balancing permeability and solubility for AB01291767-01. Following Lipinski's Rule of Five, AB01291767-01 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 AB01291767-01?
The CAS number of AB01291767-01 is 896841-94-4.
What is the molecular formula of AB01291767-01?
The molecular formula of AB01291767-01 is C22H25N7S.
What is the molecular weight of AB01291767-01?
The molecular weight of AB01291767-01 is 419.19 g/mol.
Where can I buy AB01291767-01?
You can request a quote for AB01291767-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB01291767-01?
Yes, KEHONG BIO provides custom synthesis services for AB01291767-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.