BAS 00584718
TL;DR: BAS 00584718 (CAS 313506-76-2) is a chemical compound with molecular formula C27H18BrNO6 and molecular weight 531.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(4-bromophenyl)-1-(3-methoxyphenyl)spiro[3a,6a-dihydro-1H-furo[3,4-c]pyrrole-3,2'-indene]-1',3',4,6-tetrone
Also Known As: BAS 00584718, 5-(4-bromophenyl)-1-(3-methoxyphenyl)spiro[3a,6a-dihydro-1H-furo[3,4-c]pyrrole-3,2'-indene]-1',3',4,6-tetrone, 5-(4-bromophenyl)-1-(3-methoxyphenyl)-3a,6a-dihydrosprio[1H-furo[3,4-c]pyrrole-3,2'-(1'H)-indene]-1',3',4,6(2'H,3H,5H)-tetrone, 2-(4-bromophenyl)-4-(3-methoxyphenyl)spiro[2,4,5,6,3a,6a-hexahydro-5-oxa-2-aza pentalene-6,2'-2-hydrocyclopenta[1,2-a]benzene]-1,3,9,11-tetraone, 5-(4-bromophenyl)-3-(3-methoxyphenyl)-3,3a-dihydrospiro[furo[3,4-c]pyrrole-1,2'-indene]-1',3',4,6(5H,6aH)-tetraone
| Molecular Formula | C27H18BrNO6 |
|---|---|
| Molecular Weight | 531.03 g/mol |
| LogP | 4.1528 |
| Topological Polar Surface Area | 89.98 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 531.03174 |
| Heavy Atoms | 35 |
| Complexity | 1396.5939 |
Chemical Identifiers
| CAS Number | 313506-76-2 |
|---|---|
| SMILES | COC1=CC=CC(=C1)C2C3C(C(=O)N(C3=O)C4=CC=C(C=C4)Br)C5(O2)C(=O)C6=CC=CC=C6C5=O |
Product Overview
BAS 00584718 (CAS 313506-76-2), with molecular formula C27H18BrNO6 and molecular weight 531.03 g/mol. IUPAC: 5-(4-bromophenyl)-1-(3-methoxyphenyl)spiro[3a,6a-dihydro-1H-furo[3,4-c]pyrrole-3,2'-indene]-1',3',4,6-tetrone.
Chemical Property Profile of BAS 00584718
Property Insights of BAS 00584718
The XLogP value of 4.1528 indicates that BAS 00584718 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 89.98 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00584718. Following Lipinski's Rule of Five, BAS 00584718 has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 00584718?
The CAS number of BAS 00584718 is 313506-76-2.
What is the molecular formula of BAS 00584718?
The molecular formula of BAS 00584718 is C27H18BrNO6.
What is the molecular weight of BAS 00584718?
The molecular weight of BAS 00584718 is 531.03 g/mol.
Where can I buy BAS 00584718?
You can request a quote for BAS 00584718 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00584718?
Yes, KEHONG BIO provides custom synthesis services for BAS 00584718 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.