BAS 00867441
TL;DR: BAS 00867441 (CAS 470695-40-0) is a chemical compound with molecular formula C25H26N2O7 and molecular weight 466.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-4-[[1-(4-ethoxyphenyl)-2,5-dioxopyrrolidin-3-yl]-[2-(4-methoxyphenyl)ethyl]amino]-4-oxobut-2-enoic acid
Also Known As: BAS 00867441, (2E)-4-{[1-(4-ethoxyphenyl)-2,5-dioxopyrrolidin-3-yl][2-(4-methoxyphenyl)ethyl]amino}-4-oxobut-2-enoic acid, (E)-4-[[1-(4-ethoxyphenyl)-2,5-dioxopyrrolidin-3-yl]-[2-(4-methoxyphenyl)ethyl]amino]-4-oxobut-2-enoic acid, (2E)-3-{N-[1-(4-ethoxyphenyl)-2,5-dioxoazolidin-3-yl]-N-[2-(4-methoxyphenyl)et hyl]carbamoyl}prop-2-enoic acid, (E)-4-((1-(4-ethoxyphenyl)-2,5-dioxopyrrolidin-3-yl)(4-methoxyphenethyl)amino)-4-oxobut-2-enoic acid
| Molecular Formula | C25H26N2O7 |
|---|---|
| Molecular Weight | 466.17 g/mol |
| LogP | 2.4379 |
| Topological Polar Surface Area | 113.45 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 10 |
| Exact Mass | 466.174 |
| Heavy Atoms | 34 |
| Complexity | 1077.4479 |
Chemical Identifiers
| CAS Number | 470695-40-0 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)N2C(=O)CC(C2=O)N(CCC3=CC=C(C=C3)OC)C(=O)/C=C/C(=O)O |
Product Overview
BAS 00867441 (CAS 470695-40-0), with molecular formula C25H26N2O7 and molecular weight 466.17 g/mol. IUPAC: (E)-4-[[1-(4-ethoxyphenyl)-2,5-dioxopyrrolidin-3-yl]-[2-(4-methoxyphenyl)ethyl]amino]-4-oxobut-2-enoic acid.
Chemical Property Profile of BAS 00867441
Property Insights of BAS 00867441
The XLogP value of 2.4379 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 00867441. The TPSA of 113.45 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00867441. Following Lipinski's Rule of Five, BAS 00867441 has 1 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 00867441?
The CAS number of BAS 00867441 is 470695-40-0.
What is the molecular formula of BAS 00867441?
The molecular formula of BAS 00867441 is C25H26N2O7.
What is the molecular weight of BAS 00867441?
The molecular weight of BAS 00867441 is 466.17 g/mol.
Where can I buy BAS 00867441?
You can request a quote for BAS 00867441 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00867441?
Yes, KEHONG BIO provides custom synthesis services for BAS 00867441 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.