BAS 13558025
TL;DR: BAS 13558025 (CAS 878440-07-4) is a chemical compound with molecular formula C21H24N2O4 and molecular weight 368.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-(4-methoxyphenyl)piperazine-1-carbonyl]-3-methyl-6,7-dihydro-5H-1-benzofuran-4-one
Also Known As: BAS 13558025, BRD-K68121264-001-08-2, 2-[4-(4-methoxyphenyl)piperazine-1-carbonyl]-3-methyl-6,7-dihydro-5H-1-benzofuran-4-one, 2-(4-(4-methoxyphenyl)piperazine-1-carbonyl)-3-methyl-6,7-dihydrobenzofuran-4(5H)-one, 2-[4-(4-Methoxy-phenyl)-piperazine-1-carbonyl]-3-methyl-6,7-dihydro-5H-benzofuran-4-one
| Molecular Formula | C21H24N2O4 |
|---|---|
| Molecular Weight | 368.17 g/mol |
| LogP | 3.07802 |
| Topological Polar Surface Area | 62.99 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 368.1736 |
| Heavy Atoms | 27 |
| Complexity | 861.05194 |
Chemical Identifiers
| CAS Number | 878440-07-4 |
|---|---|
| SMILES | CC1=C(OC2=C1C(=O)CCC2)C(=O)N3CCN(CC3)C4=CC=C(C=C4)OC |
Product Overview
BAS 13558025 (CAS 878440-07-4), with molecular formula C21H24N2O4 and molecular weight 368.17 g/mol. IUPAC: 2-[4-(4-methoxyphenyl)piperazine-1-carbonyl]-3-methyl-6,7-dihydro-5H-1-benzofuran-4-one.
Chemical Property Profile of BAS 13558025
Property Insights of BAS 13558025
The XLogP value of 3.07802 indicates that BAS 13558025 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 62.99 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 13558025. Following Lipinski's Rule of Five, BAS 13558025 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 13558025?
The CAS number of BAS 13558025 is 878440-07-4.
What is the molecular formula of BAS 13558025?
The molecular formula of BAS 13558025 is C21H24N2O4.
What is the molecular weight of BAS 13558025?
The molecular weight of BAS 13558025 is 368.17 g/mol.
Where can I buy BAS 13558025?
You can request a quote for BAS 13558025 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 13558025?
Yes, KEHONG BIO provides custom synthesis services for BAS 13558025 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.