BIM-0042538.P001
TL;DR: BIM-0042538.P001 (CAS 6049-22-5) is a chemical compound with molecular formula C29H33N3O4 and molecular weight 487.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-benzhydrylpiperazin-1-yl)-2-[(E)-1-(3,4-dimethoxyphenyl)ethylideneamino]oxyethanone
Also Known As: BIM-0042538.P001, 1-(4-benzhydrylpiperazin-1-yl)-2-[1-(3,4-dimethoxyphenyl)ethylideneamino]oxyethanone, 1-(4-benzhydrylpiperazin-1-yl)-2-[(E)-1-(3,4-dimethoxyphenyl)ethylideneamino]oxyethanone, 2-({[(1E)-1-(3,4-dimethoxyphenyl)ethylidene]amino}oxy)-1-[4-(diphenylmethyl)piperazin-1-yl]ethanone
| Molecular Formula | C29H33N3O4 |
|---|---|
| Molecular Weight | 487.25 g/mol |
| LogP | 4.3782 |
| Topological Polar Surface Area | 63.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 487.2471 |
| Heavy Atoms | 36 |
| Complexity | 1120.1515 |
Chemical Identifiers
| CAS Number | 6049-22-5 |
|---|---|
| SMILES | C/C(=N\OCC(=O)N1CCN(CC1)C(C2=CC=CC=C2)C3=CC=CC=C3)/C4=CC(=C(C=C4)OC)OC |
Product Overview
BIM-0042538.P001 (CAS 6049-22-5), with molecular formula C29H33N3O4 and molecular weight 487.25 g/mol. IUPAC: 1-(4-benzhydrylpiperazin-1-yl)-2-[(E)-1-(3,4-dimethoxyphenyl)ethylideneamino]oxyethanone.
Chemical Property Profile of BIM-0042538.P001
Property Insights of BIM-0042538.P001
The XLogP value of 4.3782 indicates that BIM-0042538.P001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.6 Ų falls within the moderate polarity range, balancing permeability and solubility for BIM-0042538.P001. Following Lipinski's Rule of Five, BIM-0042538.P001 has 0 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-0042538.P001?
The CAS number of BIM-0042538.P001 is 6049-22-5.
What is the molecular formula of BIM-0042538.P001?
The molecular formula of BIM-0042538.P001 is C29H33N3O4.
What is the molecular weight of BIM-0042538.P001?
The molecular weight of BIM-0042538.P001 is 487.25 g/mol.
Where can I buy BIM-0042538.P001?
You can request a quote for BIM-0042538.P001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BIM-0042538.P001?
Yes, KEHONG BIO provides custom synthesis services for BIM-0042538.P001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.