BAS 00323777
TL;DR: BAS 00323777 (CAS 404919-99-9) is a chemical compound with molecular formula C27H27BrO4 and molecular weight 494.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
9-[5-(4-bromophenyl)furan-2-yl]-3,3,6,6-tetramethyl-4,5,7,9-tetrahydro-2H-xanthene-1,8-dione
Also Known As: BAS 00323777, 9-(5-(4-bromophenyl)furan-2-yl)-3,3,6,6-tetramethyl-3,4,5,6,7,9-hexahydro-1H-xanthene-1,8(2H)-dione, 9-[5-(4-bromophenyl)(2-furyl)]-3,3,6,6-tetramethyl-2,3,4,5,6,7-hexahydroxanthe ne-1,8-dione, 9-[5-(4-bromophenyl)furan-2-yl]-3,3,6,6-tetramethyl-3,4,5,6,7,9-hexahydro-1H-xanthene-1,8(2H)-dione, 9-[5-(4-bromophenyl)furan-2-yl]-3,3,6,6-tetramethyl-4,5,7,9-tetrahydro-2H-xanthene-1,8-dione
| Molecular Formula | C27H27BrO4 |
|---|---|
| Molecular Weight | 494.11 g/mol |
| LogP | 7.1093 |
| Topological Polar Surface Area | 56.51 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 494.10928 |
| Heavy Atoms | 32 |
| Complexity | 1138.4995 |
Chemical Identifiers
| CAS Number | 404919-99-9 |
|---|---|
| SMILES | CC1(CC2=C(C(C3=C(O2)CC(CC3=O)(C)C)C4=CC=C(O4)C5=CC=C(C=C5)Br)C(=O)C1)C |
Product Overview
BAS 00323777 (CAS 404919-99-9), with molecular formula C27H27BrO4 and molecular weight 494.11 g/mol. IUPAC: 9-[5-(4-bromophenyl)furan-2-yl]-3,3,6,6-tetramethyl-4,5,7,9-tetrahydro-2H-xanthene-1,8-dione.
Chemical Property Profile of BAS 00323777
Property Insights of BAS 00323777
The XLogP value of 7.1093 indicates that BAS 00323777 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 56.51 Ų, BAS 00323777 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 00323777 has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 00323777?
The CAS number of BAS 00323777 is 404919-99-9.
What is the molecular formula of BAS 00323777?
The molecular formula of BAS 00323777 is C27H27BrO4.
What is the molecular weight of BAS 00323777?
The molecular weight of BAS 00323777 is 494.11 g/mol.
Where can I buy BAS 00323777?
You can request a quote for BAS 00323777 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00323777?
Yes, KEHONG BIO provides custom synthesis services for BAS 00323777 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.