BAS 09529075
TL;DR: BAS 09529075 (CAS 712347-57-4) is a chemical compound with molecular formula C19H18BrN3O4 and molecular weight 431.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[3-(3-bromophenyl)-4,5-dihydro-1,2-oxazol-5-yl]-[4-(furan-2-carbonyl)piperazin-1-yl]methanone
Also Known As: BAS 09529075, AN-329/43211397, [3-(3-bromophenyl)-4,5-dihydro-1,2-oxazol-5-yl]-[4-(furan-2-carbonyl)piperazin-1-yl]methanone, 1-{[3-(3-bromophenyl)-4,5-dihydro-5-isoxazolyl]carbonyl}-4-(2-furoyl)piperazine, 3-(3-bromophenyl)(4,5-dihydroisoxazol-5-yl) 4-(2-furylcarbonyl)piperazinyl ket one
| Molecular Formula | C19H18BrN3O4 |
|---|---|
| Molecular Weight | 431.05 g/mol |
| LogP | 2.5197 |
| Topological Polar Surface Area | 75.35 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 431.04807 |
| Heavy Atoms | 27 |
| Complexity | 872.8397 |
Chemical Identifiers
| CAS Number | 712347-57-4 |
|---|---|
| SMILES | C1CN(CCN1C(=O)C2CC(=NO2)C3=CC(=CC=C3)Br)C(=O)C4=CC=CO4 |
Product Overview
BAS 09529075 (CAS 712347-57-4), with molecular formula C19H18BrN3O4 and molecular weight 431.05 g/mol. IUPAC: [3-(3-bromophenyl)-4,5-dihydro-1,2-oxazol-5-yl]-[4-(furan-2-carbonyl)piperazin-1-yl]methanone.
Chemical Property Profile of BAS 09529075
Property Insights of BAS 09529075
The XLogP value of 2.5197 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 09529075. The TPSA of 75.35 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 09529075. Following Lipinski's Rule of Five, BAS 09529075 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 BAS 09529075?
The CAS number of BAS 09529075 is 712347-57-4.
What is the molecular formula of BAS 09529075?
The molecular formula of BAS 09529075 is C19H18BrN3O4.
What is the molecular weight of BAS 09529075?
The molecular weight of BAS 09529075 is 431.05 g/mol.
Where can I buy BAS 09529075?
You can request a quote for BAS 09529075 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 09529075?
Yes, KEHONG BIO provides custom synthesis services for BAS 09529075 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.