BAS 01108362
TL;DR: BAS 01108362 (CAS 1164523-72-1) is a chemical compound with molecular formula C22H18N2O and molecular weight 326.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(7E)-2-amino-7-benzylidene-4-phenyl-5,6-dihydro-4H-cyclopenta[b]pyran-3-carbonitrile
Also Known As: BAS 01108362, A1587/0068901, 2-amino-7-benzylidene-4-phenyl-4,5,6,7-tetrahydrocyclopenta[b]pyran-3-carbonitrile, (7E)-2-amino-7-benzylidene-4-phenyl-4,5,6,7-tetrahydrocyclopenta[b]pyran-3-carbonitrile, (7E)-2-amino-7-benzylidene-4-phenyl-5,6-dihydro-4H-cyclopenta[b]pyran-3-carbonitrile
| Molecular Formula | C22H18N2O |
|---|---|
| Molecular Weight | 326.14 g/mol |
| LogP | 4.62578 |
| Topological Polar Surface Area | 59.04 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 326.1419 |
| Heavy Atoms | 25 |
| Complexity | 930.99744 |
Chemical Identifiers
| CAS Number | 1164523-72-1 |
|---|---|
| SMILES | C\1CC2=C(/C1=C/C3=CC=CC=C3)OC(=C(C2C4=CC=CC=C4)C#N)N |
Product Overview
BAS 01108362 (CAS 1164523-72-1), with molecular formula C22H18N2O and molecular weight 326.14 g/mol. IUPAC: (7E)-2-amino-7-benzylidene-4-phenyl-5,6-dihydro-4H-cyclopenta[b]pyran-3-carbonitrile.
Chemical Property Profile of BAS 01108362
Property Insights of BAS 01108362
The XLogP value of 4.62578 indicates that BAS 01108362 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.04 Ų, BAS 01108362 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 01108362 has 1 hydrogen bond donor(s) and 3 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 01108362?
The CAS number of BAS 01108362 is 1164523-72-1.
What is the molecular formula of BAS 01108362?
The molecular formula of BAS 01108362 is C22H18N2O.
What is the molecular weight of BAS 01108362?
The molecular weight of BAS 01108362 is 326.14 g/mol.
Where can I buy BAS 01108362?
You can request a quote for BAS 01108362 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01108362?
Yes, KEHONG BIO provides custom synthesis services for BAS 01108362 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.