Flustramine B
TL;DR: Flustramine B (CAS 71239-65-1) is a chemical compound with molecular formula C21H29BrN2 and molecular weight 388.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3aS,8bR)-6-bromo-3-methyl-4,8b-bis(3-methylbut-2-enyl)-2,3a-dihydro-1H-pyrrolo[2,3-b]indole
Also Known As: Flustramine B, ent-Flustramine B, J1.560.839K, (3aS,8bR)-6-bromo-3-methyl-4,8b-bis(3-methylbut-2-enyl)-2,3a-dihydro-1H-pyrrolo[2,3-b]indole, (3aR)-1-Methyl-3abeta,8-diprenyl-6-bromo-1,2,3,3a,8,8abeta-hexahydropyrrolo[2,3-b]indole
| Molecular Formula | C21H29BrN2 |
|---|---|
| Molecular Weight | 388.15 g/mol |
| LogP | 6.4 |
| Topological Polar Surface Area | 6.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 388.1514 |
| Heavy Atoms | 24 |
| Complexity | 518.0 |
Chemical Identifiers
| CAS Number | 71239-65-1 |
|---|---|
| SMILES | CC(=CC[C@]12CCN([C@H]1N(C3=C2C=CC(=C3)Br)CC=C(C)C)C)C |
| InChIKey | AXCACHVTDPCEAS-LEWJYISDSA-N |
Product Overview
Flustramine B (CAS 71239-65-1), with molecular formula C21H29BrN2 and molecular weight 388.15 g/mol. IUPAC: (3aS,8bR)-6-bromo-3-methyl-4,8b-bis(3-methylbut-2-enyl)-2,3a-dihydro-1H-pyrrolo[2,3-b]indole.
Chemical Property Profile of Flustramine B
Property Insights of Flustramine B
The XLogP value of 6.4 indicates that Flustramine B is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 6.5 Ų, Flustramine B exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Flustramine B has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Flustramine B?
The CAS number of Flustramine B is 71239-65-1.
What is the molecular formula of Flustramine B?
The molecular formula of Flustramine B is C21H29BrN2.
What is the molecular weight of Flustramine B?
The molecular weight of Flustramine B is 388.15 g/mol.
Where can I buy Flustramine B?
You can request a quote for Flustramine B directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Flustramine B?
Yes, KEHONG BIO provides custom synthesis services for Flustramine B and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.