BAS 01403010
TL;DR: BAS 01403010 (CAS 309922-60-9) is a chemical compound with molecular formula C22H21NO7 and molecular weight 411.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(3E)-2-(4-hydroxy-3-methoxyphenyl)-3-[hydroxy(phenyl)methylidene]-4,5-dioxopyrrolidin-1-yl]butanoic acid
Also Known As: BAS 01403010, 4-[3-BENZOYL-4-HYDROXY-2-(4-HYDROXY-3-METHOXYPHENYL)-5-OXO-2,5-DIHYDRO-1H-PYRROL-1-YL]BUTANOIC ACID, 4-(3-benzoyl-4-hydroxy-2-(4-hydroxy-3-methoxyphenyl)-5-oxo-2,5-dihydro-1H-pyrrol-1-yl)butanoic acid, 4-[(3E)-2-(4-hydroxy-3-methoxyphenyl)-3-[hydroxy(phenyl)methylidene]-4,5-dioxopyrrolidin-1-yl]butanoic acid
| Molecular Formula | C22H21NO7 |
|---|---|
| Molecular Weight | 411.13 g/mol |
| LogP | 2.6873 |
| Topological Polar Surface Area | 124.37 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 411.1318 |
| Heavy Atoms | 30 |
| Complexity | 1013.40106 |
Chemical Identifiers
| CAS Number | 309922-60-9 |
|---|---|
| SMILES | COC1=C(C=CC(=C1)C2/C(=C(/C3=CC=CC=C3)\O)/C(=O)C(=O)N2CCCC(=O)O)O |
Product Overview
BAS 01403010 (CAS 309922-60-9), with molecular formula C22H21NO7 and molecular weight 411.13 g/mol. IUPAC: 4-[(3E)-2-(4-hydroxy-3-methoxyphenyl)-3-[hydroxy(phenyl)methylidene]-4,5-dioxopyrrolidin-1-yl]butanoic acid.
Chemical Property Profile of BAS 01403010
Property Insights of BAS 01403010
The XLogP value of 2.6873 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 01403010. The TPSA of 124.37 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 01403010. Following Lipinski's Rule of Five, BAS 01403010 has 3 hydrogen bond donor(s) and 6 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 01403010?
The CAS number of BAS 01403010 is 309922-60-9.
What is the molecular formula of BAS 01403010?
The molecular formula of BAS 01403010 is C22H21NO7.
What is the molecular weight of BAS 01403010?
The molecular weight of BAS 01403010 is 411.13 g/mol.
Where can I buy BAS 01403010?
You can request a quote for BAS 01403010 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01403010?
Yes, KEHONG BIO provides custom synthesis services for BAS 01403010 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.