BAS 00702433
TL;DR: BAS 00702433 (CAS 331966-20-2) is a chemical compound with molecular formula C18H14BrClN2O3S and molecular weight 451.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[1-(3-bromophenyl)-2,5-dioxopyrrolidin-3-yl]sulfanyl-N-(4-chlorophenyl)acetamide
Also Known As: BAS 00702433, BIM-0014774.P001, 2-{[1-(3-bromophenyl)-2,5-dioxopyrrolidin-3-yl]sulfanyl}-N-(4-chlorophenyl)acetamide, 2-[1-(3-bromophenyl)-2,5-dioxopyrrolidin-3-yl]sulfanyl-N-(4-chlorophenyl)acetamide, A0595/0027522
| Molecular Formula | C18H14BrClN2O3S |
|---|---|
| Molecular Weight | 451.96 g/mol |
| LogP | 4.1063 |
| Topological Polar Surface Area | 66.48 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 451.9597 |
| Heavy Atoms | 26 |
| Complexity | 859.76965 |
Chemical Identifiers
| CAS Number | 331966-20-2 |
|---|---|
| SMILES | C1C(C(=O)N(C1=O)C2=CC(=CC=C2)Br)SCC(=O)NC3=CC=C(C=C3)Cl |
Product Overview
BAS 00702433 (CAS 331966-20-2), with molecular formula C18H14BrClN2O3S and molecular weight 451.96 g/mol. IUPAC: 2-[1-(3-bromophenyl)-2,5-dioxopyrrolidin-3-yl]sulfanyl-N-(4-chlorophenyl)acetamide.
Chemical Property Profile of BAS 00702433
Property Insights of BAS 00702433
The XLogP value of 4.1063 indicates that BAS 00702433 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.48 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00702433. Following Lipinski's Rule of Five, BAS 00702433 has 1 hydrogen bond donor(s) and 4 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 BAS 00702433?
The CAS number of BAS 00702433 is 331966-20-2.
What is the molecular formula of BAS 00702433?
The molecular formula of BAS 00702433 is C18H14BrClN2O3S.
What is the molecular weight of BAS 00702433?
The molecular weight of BAS 00702433 is 451.96 g/mol.
Where can I buy BAS 00702433?
You can request a quote for BAS 00702433 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00702433?
Yes, KEHONG BIO provides custom synthesis services for BAS 00702433 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.