TRV6H8T8KV
TL;DR: TRV6H8T8KV (CAS 79053-81-9) is a chemical compound with molecular formula C47H48Br2N6O2 and molecular weight 886.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-[3-[7-[3-(3,8-diamino-5-methylphenanthridin-5-ium-6-yl)phenoxy]heptoxy]phenyl]-5-methylphenanthridin-5-ium-3,8-diamine dibromide
Also Known As: Phenanthridinium, 6,6'-(1,7-heptanediylbis(oxy-3,1-phenylene))bis(3,8-diamino-5-methyl-, dibromide, 6-[3-[7-[3-(3,8-diamino-5-methylphenanthridin-5-ium-6-yl)phe, 6-[3-[7-[3-(3,8-diamino-5-methylphenanthridin-5-ium-6-yl)phenoxy]heptoxy]phenyl]-5-methylphenanthridin-5-ium-3,8-diamine dibromide, 6-[3-[7-[3-(3,8-diamino-5-methylphenanthridin-5-ium-6-yl)phenoxy]heptoxy]phenyl]-5-methylphenanthridin-5-ium-3,8-diamine,dibromide
| Molecular Formula | C47H48Br2N6O2 |
|---|---|
| Molecular Weight | 886.22 g/mol |
| LogP | 3.0275 |
| Topological Polar Surface Area | 130.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 12 |
| Exact Mass | 886.2205 |
| Heavy Atoms | 57 |
| Complexity | 1100.0 |
Chemical Identifiers
| CAS Number | 79053-81-9 |
|---|---|
| SMILES | C[N+]1=C2C=C(C=CC2=C3C=CC(=CC3=C1C4=CC(=CC=C4)OCCCCCCCOC5=CC=CC(=C5)C6=C7C=C(C=CC7=C8C=CC(=CC8=[N+]6C)N)N)N)N.[Br-].[Br-] |
| InChIKey | LAGWYFIXLVDZJL-UHFFFAOYSA-N |
Product Overview
TRV6H8T8KV (CAS 79053-81-9), with molecular formula C47H48Br2N6O2 and molecular weight 886.22 g/mol. IUPAC: 6-[3-[7-[3-(3,8-diamino-5-methylphenanthridin-5-ium-6-yl)phenoxy]heptoxy]phenyl]-5-methylphenanthridin-5-ium-3,8-diamine dibromide.
Chemical Property Profile of TRV6H8T8KV
Property Insights of TRV6H8T8KV
The XLogP value of 3.0275 indicates that TRV6H8T8KV is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 130.0 Ų falls within the moderate polarity range, balancing permeability and solubility for TRV6H8T8KV. Following Lipinski's Rule of Five, TRV6H8T8KV has 4 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of TRV6H8T8KV?
The CAS number of TRV6H8T8KV is 79053-81-9.
What is the molecular formula of TRV6H8T8KV?
The molecular formula of TRV6H8T8KV is C47H48Br2N6O2.
What is the molecular weight of TRV6H8T8KV?
The molecular weight of TRV6H8T8KV is 886.22 g/mol.
Where can I buy TRV6H8T8KV?
You can request a quote for TRV6H8T8KV directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for TRV6H8T8KV?
Yes, KEHONG BIO provides custom synthesis services for TRV6H8T8KV and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.