BAS 09896352
TL;DR: BAS 09896352 (CAS 861124-44-9) is a chemical compound with molecular formula C21H22N4O and molecular weight 346.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
11-(oxolan-2-ylmethylamino)-7,8,9,10-tetrahydrobenzimidazolo[1,2-b]isoquinoline-6-carbonitrile
Also Known As: BAS 09896352, F1727-0055, 11-(((tetrahydrofuran-2-yl)methyl)amino)-7,8,9,10-tetrahydrobenzo[4,5]imidazo[1,2-b]isoquinoline-6-carbonitrile, 9-{[(oxolan-2-yl)methyl]amino}-10,17-diazatetracyclo[8.7.0.0^{3,8}.0^{11,16}]heptadeca-1(17),2,8,11(16),12,14-hexaene-2-carbonitrile, 11-(oxolan-2-ylmethylamino)-7,8,9,10-tetrahydrobenzimidazolo[1,2-b]isoquinoline-6-carbonitrile
| Molecular Formula | C21H22N4O |
|---|---|
| Molecular Weight | 346.18 g/mol |
| LogP | 3.82888 |
| Topological Polar Surface Area | 62.35 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 346.17935 |
| Heavy Atoms | 26 |
| Complexity | 1024.075 |
Chemical Identifiers
| CAS Number | 861124-44-9 |
|---|---|
| SMILES | C1CCC2=C(N3C4=CC=CC=C4N=C3C(=C2C1)C#N)NCC5CCCO5 |
Product Overview
BAS 09896352 (CAS 861124-44-9), with molecular formula C21H22N4O and molecular weight 346.18 g/mol. IUPAC: 11-(oxolan-2-ylmethylamino)-7,8,9,10-tetrahydrobenzimidazolo[1,2-b]isoquinoline-6-carbonitrile.
Chemical Property Profile of BAS 09896352
Property Insights of BAS 09896352
The XLogP value of 3.82888 indicates that BAS 09896352 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 62.35 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 09896352. Following Lipinski's Rule of Five, BAS 09896352 has 1 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 BAS 09896352?
The CAS number of BAS 09896352 is 861124-44-9.
What is the molecular formula of BAS 09896352?
The molecular formula of BAS 09896352 is C21H22N4O.
What is the molecular weight of BAS 09896352?
The molecular weight of BAS 09896352 is 346.18 g/mol.
Where can I buy BAS 09896352?
You can request a quote for BAS 09896352 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 09896352?
Yes, KEHONG BIO provides custom synthesis services for BAS 09896352 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.