WY 930
TL;DR: WY 930 (CAS 5781-45-3) is a chemical compound with molecular formula C35H45ClN4O6 and molecular weight 652.30 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[bis[2-[methyl-(2-methyl-1-phenylpropan-2-yl)amino]-2-oxoethyl]amino]ethyl 4-nitrobenzoate;hydrochloride
Also Known As: Acetamide, 2,2'-((2-((4-nitrobenzoyl)oxy)ethyl)imino)bis(N-(1,1-dimethyl-2-phenylethyl)-N-methyl-, monohydrochloride, 2-(Bis{2-[methyl(2-methyl-1-phenylpropan-2-yl)amino]-2-oxoethyl}amino)ethyl 4-nitrobenzoate--hydrogen chloride (1/1), 2-[bis[2-[methyl-(2-methyl-1-phenylpropan-2-yl)amino]-2-oxoethyl]amino]ethyl 4-nitrobenzoate hydrochloride, RefChem:388407
| Molecular Formula | C35H45ClN4O6 |
|---|---|
| Molecular Weight | 652.30 g/mol |
| LogP | 5.4348 |
| Topological Polar Surface Area | 116.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 15 |
| Exact Mass | 652.30273 |
| Heavy Atoms | 46 |
| Complexity | 923.0 |
Chemical Identifiers
| CAS Number | 5781-45-3 |
|---|---|
| SMILES | CC(C)(CC1=CC=CC=C1)N(C)C(=O)CN(CCOC(=O)C2=CC=C(C=C2)[N+](=O)[O-])CC(=O)N(C)C(C)(C)CC3=CC=CC=C3.Cl |
| InChIKey | PQPKCUDCZFCUJY-UHFFFAOYSA-N |
Product Overview
WY 930 (CAS 5781-45-3), with molecular formula C35H45ClN4O6 and molecular weight 652.30 g/mol. IUPAC: 2-[bis[2-[methyl-(2-methyl-1-phenylpropan-2-yl)amino]-2-oxoethyl]amino]ethyl 4-nitrobenzoate;hydrochloride.
Chemical Property Profile of WY 930
Property Insights of WY 930
The XLogP value of 5.4348 indicates that WY 930 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 116.0 Ų falls within the moderate polarity range, balancing permeability and solubility for WY 930. Following Lipinski's Rule of Five, WY 930 has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of WY 930?
The CAS number of WY 930 is 5781-45-3.
What is the molecular formula of WY 930?
The molecular formula of WY 930 is C35H45ClN4O6.
What is the molecular weight of WY 930?
The molecular weight of WY 930 is 652.30 g/mol.
Where can I buy WY 930?
You can request a quote for WY 930 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for WY 930?
Yes, KEHONG BIO provides custom synthesis services for WY 930 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.