BAS 00702591
TL;DR: BAS 00702591 (CAS 311334-19-7) is a chemical compound with molecular formula C24H27ClN2O4S and molecular weight 474.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-chlorophenyl)-2-[1-(4-hexoxyphenyl)-2,5-dioxopyrrolidin-3-yl]sulfanylacetamide
Also Known As: BAS 00702591, A1178/0054623, N-(4-chlorophenyl)-2-({1-[4-(hexyloxy)phenyl]-2,5-dioxopyrrolidin-3-yl}sulfanyl)acetamide, N-(4-chlorophenyl)-2-((1-(4-(hexyloxy)phenyl)-2,5-dioxopyrrolidin-3-yl)thio)acetamide, N-(4-chlorophenyl)-2-({1-[4-(hexyloxy)phenyl]-2,5-dioxo-3-pyrrolidinyl}sulfanyl)acetamide
| Molecular Formula | C24H27ClN2O4S |
|---|---|
| Molecular Weight | 474.14 g/mol |
| LogP | 5.3029 |
| Topological Polar Surface Area | 75.71 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 11 |
| Exact Mass | 474.138 |
| Heavy Atoms | 32 |
| Complexity | 934.0203 |
Chemical Identifiers
| CAS Number | 311334-19-7 |
|---|---|
| SMILES | CCCCCCOC1=CC=C(C=C1)N2C(=O)CC(C2=O)SCC(=O)NC3=CC=C(C=C3)Cl |
Product Overview
BAS 00702591 (CAS 311334-19-7), with molecular formula C24H27ClN2O4S and molecular weight 474.14 g/mol. IUPAC: N-(4-chlorophenyl)-2-[1-(4-hexoxyphenyl)-2,5-dioxopyrrolidin-3-yl]sulfanylacetamide.
Chemical Property Profile of BAS 00702591
Property Insights of BAS 00702591
The XLogP value of 5.3029 indicates that BAS 00702591 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 75.71 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00702591. Following Lipinski's Rule of Five, BAS 00702591 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 00702591?
The CAS number of BAS 00702591 is 311334-19-7.
What is the molecular formula of BAS 00702591?
The molecular formula of BAS 00702591 is C24H27ClN2O4S.
What is the molecular weight of BAS 00702591?
The molecular weight of BAS 00702591 is 474.14 g/mol.
Where can I buy BAS 00702591?
You can request a quote for BAS 00702591 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00702591?
Yes, KEHONG BIO provides custom synthesis services for BAS 00702591 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.