BIM-0044149.P001
TL;DR: BIM-0044149.P001 (CAS 340231-30-3) is a chemical compound with molecular formula C21H16Cl2N2O7 and molecular weight 478.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-chloro-4-[(E)-[1-(4-chlorophenyl)-2,4,6-trioxo-1,3-diazinan-5-ylidene]methyl]-6-ethoxyphenoxy]acetic acid
Also Known As: BIM-0044149.P001, (2-chloro-4-{(E)-[1-(4-chlorophenyl)-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene]methyl}-6-ethoxyphenoxy)acetic acid, (E)-2-(2-chloro-4-((1-(4-chlorophenyl)-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)methyl)-6-ethoxyphenoxy)acetic acid, 2-[2-chloro-4-[(E)-[1-(4-chlorophenyl)-2,4,6-trioxo-1,3-diazinan-5-ylidene]methyl]-6-ethoxyphenoxy]acetic acid
| Molecular Formula | C21H16Cl2N2O7 |
|---|---|
| Molecular Weight | 478.03 g/mol |
| LogP | 3.5219 |
| Topological Polar Surface Area | 122.24 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 478.03345 |
| Heavy Atoms | 32 |
| Complexity | 1129.7133 |
Chemical Identifiers
| CAS Number | 340231-30-3 |
|---|---|
| SMILES | CCOC1=C(C(=CC(=C1)/C=C/2\C(=O)NC(=O)N(C2=O)C3=CC=C(C=C3)Cl)Cl)OCC(=O)O |
Product Overview
BIM-0044149.P001 (CAS 340231-30-3), with molecular formula C21H16Cl2N2O7 and molecular weight 478.03 g/mol. IUPAC: 2-[2-chloro-4-[(E)-[1-(4-chlorophenyl)-2,4,6-trioxo-1,3-diazinan-5-ylidene]methyl]-6-ethoxyphenoxy]acetic acid.
Chemical Property Profile of BIM-0044149.P001
Property Insights of BIM-0044149.P001
The XLogP value of 3.5219 indicates that BIM-0044149.P001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 122.24 Ų falls within the moderate polarity range, balancing permeability and solubility for BIM-0044149.P001. Following Lipinski's Rule of Five, BIM-0044149.P001 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 BIM-0044149.P001?
The CAS number of BIM-0044149.P001 is 340231-30-3.
What is the molecular formula of BIM-0044149.P001?
The molecular formula of BIM-0044149.P001 is C21H16Cl2N2O7.
What is the molecular weight of BIM-0044149.P001?
The molecular weight of BIM-0044149.P001 is 478.03 g/mol.
Where can I buy BIM-0044149.P001?
You can request a quote for BIM-0044149.P001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BIM-0044149.P001?
Yes, KEHONG BIO provides custom synthesis services for BIM-0044149.P001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.