BAS 00916106
TL;DR: BAS 00916106 (CAS 499100-79-7) is a chemical compound with molecular formula C26H14Cl3NO5 and molecular weight 524.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-chlorophenyl)-5-(2,3-dichlorophenyl)spiro[3a,6a-dihydro-1H-furo[3,4-c]pyrrole-3,2'-indene]-1',3',4,6-tetrone
Also Known As: BAS 00916106, 3-(4-chlorophenyl)-5-(2,3-dichlorophenyl)-3a,6a-dihydrospiro[furo[3,4-c]pyrrole-1,2'-indene]-1',3',4,6(3H,5H)-tetrone, 1-(4-chlorophenyl)-5-(2,3-dichlorophenyl)spiro[3a,6a-dihydro-1H-furo[3,4-c]pyrrole-3,2'-indene]-1',3',4,6-tetrone, 2-(2,3-dichlorophenyl)-4-(4-chlorophenyl)spiro[2,4,5,6,3a,6a-hexahydro-5-oxa-2 -azapentalene-6,2'-2-hydrocyclopenta[1,2-a]benzene]-1,3,9,11-tetraone, 3-(4-chlorophenyl)-5-(2,3-dichlorophenyl)-3,3a-dihydrospiro[furo[3,4-c]pyrrole-1,2'-indene]-1',3',4,6(5H,6aH)-tetraone
| Molecular Formula | C26H14Cl3NO5 |
|---|---|
| Molecular Weight | 524.99 g/mol |
| LogP | 5.3419 |
| Topological Polar Surface Area | 80.75 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 524.9938 |
| Heavy Atoms | 35 |
| Complexity | 1433.064 |
Chemical Identifiers
| CAS Number | 499100-79-7 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=O)C3(C2=O)C4C(C(O3)C5=CC=C(C=C5)Cl)C(=O)N(C4=O)C6=C(C(=CC=C6)Cl)Cl |
Product Overview
BAS 00916106 (CAS 499100-79-7), with molecular formula C26H14Cl3NO5 and molecular weight 524.99 g/mol. IUPAC: 1-(4-chlorophenyl)-5-(2,3-dichlorophenyl)spiro[3a,6a-dihydro-1H-furo[3,4-c]pyrrole-3,2'-indene]-1',3',4,6-tetrone.
Chemical Property Profile of BAS 00916106
Property Insights of BAS 00916106
The XLogP value of 5.3419 indicates that BAS 00916106 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 00916106. Following Lipinski's Rule of Five, BAS 00916106 has 0 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 00916106?
The CAS number of BAS 00916106 is 499100-79-7.
What is the molecular formula of BAS 00916106?
The molecular formula of BAS 00916106 is C26H14Cl3NO5.
What is the molecular weight of BAS 00916106?
The molecular weight of BAS 00916106 is 524.99 g/mol.
Where can I buy BAS 00916106?
You can request a quote for BAS 00916106 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00916106?
Yes, KEHONG BIO provides custom synthesis services for BAS 00916106 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.