BIM-0038974.P001
TL;DR: BIM-0038974.P001 (CAS 423748-70-3) is a chemical compound with molecular formula C20H17ClN2O6 and molecular weight 416.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5Z)-5-[(3-chloro-5-ethoxy-4-hydroxyphenyl)methylidene]-1-(4-methoxyphenyl)-1,3-diazinane-2,4,6-trione
Also Known As: BIM-0038974.P001, (5Z)-5-(3-chloro-5-ethoxy-4-hydroxybenzylidene)-1-(4-methoxyphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione, (5Z)-5-[(3-chloro-5-ethoxy-4-hydroxyphenyl)methylidene]-1-(4-methoxyphenyl)-1,3-diazinane-2,4,6-trione
| Molecular Formula | C20H17ClN2O6 |
|---|---|
| Molecular Weight | 416.08 g/mol |
| LogP | 3.1193 |
| Topological Polar Surface Area | 105.17 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 416.0775 |
| Heavy Atoms | 29 |
| Complexity | 1016.37665 |
Chemical Identifiers
| CAS Number | 423748-70-3 |
|---|---|
| SMILES | CCOC1=C(C(=CC(=C1)/C=C\2/C(=O)NC(=O)N(C2=O)C3=CC=C(C=C3)OC)Cl)O |
Product Overview
BIM-0038974.P001 (CAS 423748-70-3), with molecular formula C20H17ClN2O6 and molecular weight 416.08 g/mol. IUPAC: (5Z)-5-[(3-chloro-5-ethoxy-4-hydroxyphenyl)methylidene]-1-(4-methoxyphenyl)-1,3-diazinane-2,4,6-trione.
Chemical Property Profile of BIM-0038974.P001
Property Insights of BIM-0038974.P001
The XLogP value of 3.1193 indicates that BIM-0038974.P001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 105.17 Ų falls within the moderate polarity range, balancing permeability and solubility for BIM-0038974.P001. Following Lipinski's Rule of Five, BIM-0038974.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-0038974.P001?
The CAS number of BIM-0038974.P001 is 423748-70-3.
What is the molecular formula of BIM-0038974.P001?
The molecular formula of BIM-0038974.P001 is C20H17ClN2O6.
What is the molecular weight of BIM-0038974.P001?
The molecular weight of BIM-0038974.P001 is 416.08 g/mol.
Where can I buy BIM-0038974.P001?
You can request a quote for BIM-0038974.P001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BIM-0038974.P001?
Yes, KEHONG BIO provides custom synthesis services for BIM-0038974.P001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.