BAS 00368435
TL;DR: BAS 00368435 (CAS 331269-80-8) is a chemical compound with molecular formula C25H18BrNO5 and molecular weight 491.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(4-bromophenyl)-2-oxoethyl] 2-(2,5-dimethylphenyl)-1,3-dioxoisoindole-5-carboxylate
Also Known As: BAS 00368435, [2-(4-bromophenyl)-2-oxoethyl] 2-(2,5-dimethylphenyl)-1,3-dioxoisoindole-5-carboxylate, 2-(4-bromophenyl)-2-oxoethyl 2-(2,5-dimethylphenyl)-1,3-dioxoisoindoline-5-carboxylate, 2-(4-bromophenyl)-2-oxoethyl 2-(2,5-dimethylphenyl)-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxylate, 2-(4-BROMOPHENYL)-2-OXOETHYL 2-(2,5-DIMETHYLPHENYL)-1,3-DIOXO-5-ISOINDOLINECARBOXYLATE
| Molecular Formula | C25H18BrNO5 |
|---|---|
| Molecular Weight | 491.04 g/mol |
| LogP | 4.90624 |
| Topological Polar Surface Area | 80.75 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 491.03683 |
| Heavy Atoms | 32 |
| Complexity | 1279.9899 |
Chemical Identifiers
| CAS Number | 331269-80-8 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)C)N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)OCC(=O)C4=CC=C(C=C4)Br |
Product Overview
BAS 00368435 (CAS 331269-80-8), with molecular formula C25H18BrNO5 and molecular weight 491.04 g/mol. IUPAC: [2-(4-bromophenyl)-2-oxoethyl] 2-(2,5-dimethylphenyl)-1,3-dioxoisoindole-5-carboxylate.
Chemical Property Profile of BAS 00368435
Property Insights of BAS 00368435
The XLogP value of 4.90624 indicates that BAS 00368435 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 80.75 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00368435. Following Lipinski's Rule of Five, BAS 00368435 has 0 hydrogen bond donor(s) and 5 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 00368435?
The CAS number of BAS 00368435 is 331269-80-8.
What is the molecular formula of BAS 00368435?
The molecular formula of BAS 00368435 is C25H18BrNO5.
What is the molecular weight of BAS 00368435?
The molecular weight of BAS 00368435 is 491.04 g/mol.
Where can I buy BAS 00368435?
You can request a quote for BAS 00368435 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00368435?
Yes, KEHONG BIO provides custom synthesis services for BAS 00368435 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.