BAS 01026995
TL;DR: BAS 01026995 (CAS 467237-61-2) is a chemical compound with molecular formula C39H26BrNO3 and molecular weight 635.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(4-bromophenyl)-1,7,8,9-tetraphenyl-4-azatricyclo[5.2.1.02,6]dec-8-ene-3,5,10-trione
Also Known As: BAS 01026995, 2-(4-bromophenyl)-4,5,6,7-tetraphenyl-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3,8(2H)-trione, 4-(4-BROMOPHENYL)-1,7,8,9-TETRAPHENYL-4-AZATRICYCLO[5.2.1.0(2),?]DEC-8-ENE-3,5,10-TRIONE
| Molecular Formula | C39H26BrNO3 |
|---|---|
| Molecular Weight | 635.11 g/mol |
| LogP | 7.638 |
| Topological Polar Surface Area | 54.45 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 635.1096 |
| Heavy Atoms | 44 |
| Complexity | 1852.8824 |
Chemical Identifiers
| CAS Number | 467237-61-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=C(C3(C4C(C2(C3=O)C5=CC=CC=C5)C(=O)N(C4=O)C6=CC=C(C=C6)Br)C7=CC=CC=C7)C8=CC=CC=C8 |
Product Overview
BAS 01026995 (CAS 467237-61-2), with molecular formula C39H26BrNO3 and molecular weight 635.11 g/mol. IUPAC: 4-(4-bromophenyl)-1,7,8,9-tetraphenyl-4-azatricyclo[5.2.1.02,6]dec-8-ene-3,5,10-trione.
Chemical Property Profile of BAS 01026995
Property Insights of BAS 01026995
The XLogP value of 7.638 indicates that BAS 01026995 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.45 Ų, BAS 01026995 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 01026995 has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 01026995?
The CAS number of BAS 01026995 is 467237-61-2.
What is the molecular formula of BAS 01026995?
The molecular formula of BAS 01026995 is C39H26BrNO3.
What is the molecular weight of BAS 01026995?
The molecular weight of BAS 01026995 is 635.11 g/mol.
Where can I buy BAS 01026995?
You can request a quote for BAS 01026995 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01026995?
Yes, KEHONG BIO provides custom synthesis services for BAS 01026995 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.