BAS 02249077
TL;DR: BAS 02249077 (CAS 1023920-31-1) is a chemical compound with molecular formula C29H31N3O4S and molecular weight 517.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[3-[2-(3,4-dimethoxyphenyl)ethyl]-5-oxo-1-phenyl-2-sulfanylideneimidazolidin-4-yl]-N-(2-phenylethyl)acetamide
Also Known As: BAS 02249077, 2-{3-[2-(3,4-dimethoxyphenyl)ethyl]-5-oxo-1-phenyl-2-thioxoimidazolidin-4-yl}-N-(2-phenylethyl)acetamide, 2-(3-(3,4-dimethoxyphenethyl)-5-oxo-1-phenyl-2-thioxoimidazolidin-4-yl)-N-phenethylacetamide, 2-[3-[2-(3,4-dimethoxyphenyl)ethyl]-5-oxo-1-phenyl-2-sulfanylideneimidazolidin-4-yl]-N-phenethylacetamide, 2-{3-[2-(3,4-DIMETHOXYPHENYL)ETHYL]-5-OXO-1-PHENYL-2-SULFANYLIDENEIMIDAZOLIDIN-4-YL}-N-(2-PHENYLETHYL)ACETAMIDE
| Molecular Formula | C29H31N3O4S |
|---|---|
| Molecular Weight | 517.20 g/mol |
| LogP | 3.9976 |
| Topological Polar Surface Area | 71.11 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 11 |
| Exact Mass | 517.20355 |
| Heavy Atoms | 37 |
| Complexity | 1236.4138 |
Chemical Identifiers
| CAS Number | 1023920-31-1 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)CCN2C(C(=O)N(C2=S)C3=CC=CC=C3)CC(=O)NCCC4=CC=CC=C4)OC |
Product Overview
BAS 02249077 (CAS 1023920-31-1), with molecular formula C29H31N3O4S and molecular weight 517.20 g/mol. IUPAC: 2-[3-[2-(3,4-dimethoxyphenyl)ethyl]-5-oxo-1-phenyl-2-sulfanylideneimidazolidin-4-yl]-N-(2-phenylethyl)acetamide.
Chemical Property Profile of BAS 02249077
Property Insights of BAS 02249077
The XLogP value of 3.9976 indicates that BAS 02249077 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 71.11 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 02249077. Following Lipinski's Rule of Five, BAS 02249077 has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 02249077?
The CAS number of BAS 02249077 is 1023920-31-1.
What is the molecular formula of BAS 02249077?
The molecular formula of BAS 02249077 is C29H31N3O4S.
What is the molecular weight of BAS 02249077?
The molecular weight of BAS 02249077 is 517.20 g/mol.
Where can I buy BAS 02249077?
You can request a quote for BAS 02249077 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 02249077?
Yes, KEHONG BIO provides custom synthesis services for BAS 02249077 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.