BAS 01157228
TL;DR: BAS 01157228 (CAS 332125-70-9) is a chemical compound with molecular formula C28H23NO7 and molecular weight 485.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[2-(3,4-dimethoxyphenyl)-4-hydroxy-5-oxo-3-[(E)-3-phenylprop-2-enoyl]-2H-pyrrol-1-yl]benzoic acid
Also Known As: BAS 01157228, (E)-3-(3-cinnamoyl-2-(3,4-dimethoxyphenyl)-4-hydroxy-5-oxo-2,5-dihydro-1H-pyrrol-1-yl)benzoic acid, 3-[2-(3,4-dimethoxyphenyl)-4-hydroxy-5-oxo-3-[(E)-3-phenylprop-2-enoyl]-2H-pyrrol-1-yl]benzoic acid, 3-{(3E)-2-(3,4-dimethoxyphenyl)-3-[(2E)-1-hydroxy-3-phenylprop-2-en-1-ylidene]-4,5-dioxopyrrolidin-1-yl}benzoic acid, 3-{2-(3,4-dimethoxyphenyl)-4-hydroxy-5-oxo-3-[(2E)-3-phenylprop-2-enoyl]-2,5-dihydro-1H-pyrrol-1-yl}benzoic acid
| Molecular Formula | C28H23NO7 |
|---|---|
| Molecular Weight | 485.15 g/mol |
| LogP | 4.5845 |
| Topological Polar Surface Area | 113.37 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 485.14746 |
| Heavy Atoms | 36 |
| Complexity | 1392.017 |
Chemical Identifiers
| CAS Number | 332125-70-9 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)C2C(=C(C(=O)N2C3=CC=CC(=C3)C(=O)O)O)C(=O)/C=C/C4=CC=CC=C4)OC |
Product Overview
BAS 01157228 (CAS 332125-70-9), with molecular formula C28H23NO7 and molecular weight 485.15 g/mol. IUPAC: 3-[2-(3,4-dimethoxyphenyl)-4-hydroxy-5-oxo-3-[(E)-3-phenylprop-2-enoyl]-2H-pyrrol-1-yl]benzoic acid.
Chemical Property Profile of BAS 01157228
Property Insights of BAS 01157228
The XLogP value of 4.5845 indicates that BAS 01157228 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 113.37 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 01157228. Following Lipinski's Rule of Five, BAS 01157228 has 2 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 01157228?
The CAS number of BAS 01157228 is 332125-70-9.
What is the molecular formula of BAS 01157228?
The molecular formula of BAS 01157228 is C28H23NO7.
What is the molecular weight of BAS 01157228?
The molecular weight of BAS 01157228 is 485.15 g/mol.
Where can I buy BAS 01157228?
You can request a quote for BAS 01157228 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01157228?
Yes, KEHONG BIO provides custom synthesis services for BAS 01157228 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.