![(7s,8s)-7,8,9,10-Tetrahydrobenzo[f]quinoline-7,8-diyl dibenzoate structure](/static/products/1118/111897-98-4.webp)
(7s,8s)-7,8,9,10-Tetrahydrobenzo[f]quinoline-7,8-diyl dibenzoate
TL;DR: (7s,8s)-7,8,9,10-Tetrahydrobenzo[f]quinoline-7,8-diyl dibenzoate (CAS 111897-98-4) is a chemical compound with molecular formula C27H21NO4 and molecular weight 423.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(7S,8S)-7-benzoyloxy-7,8,9,10-tetrahydrobenzo[f]quinolin-8-yl] benzoate
Also Known As: Sulfated ES1, KST-1A0569, (7s,8s)-7,8,9,10-tetrahydrobenzo[f]quinoline-7,8-diyl dibenzoate, Cyclo(cys-tyr-nle-gly-trp-cys)-asp-phe-NH2, 7,8,9,10-Tetrahydrobenzo[f]quinoline-7,8-diyl dibenzoate
| Molecular Formula | C27H21NO4 |
|---|---|
| Molecular Weight | 423.15 g/mol |
| LogP | 5.6 |
| Topological Polar Surface Area | 65.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 423.14706 |
| Heavy Atoms | 32 |
| Complexity | 654.0 |
Chemical Identifiers
| CAS Number | 111897-98-4 |
|---|---|
| SMILES | C1CC2=C(C=CC3=C2C=CC=N3)[C@@H]([C@H]1OC(=O)C4=CC=CC=C4)OC(=O)C5=CC=CC=C5 |
| InChIKey | LWLZRXSNANBADU-DQEYMECFSA-N |
Product Overview
(7s,8s)-7,8,9,10-Tetrahydrobenzo[f]quinoline-7,8-diyl dibenzoate (CAS 111897-98-4), with molecular formula C27H21NO4 and molecular weight 423.15 g/mol. IUPAC: [(7S,8S)-7-benzoyloxy-7,8,9,10-tetrahydrobenzo[f]quinolin-8-yl] benzoate.
Chemical Property Profile of (7s,8s)-7,8,9,10-Tetrahydrobenzo[f]quinoline-7,8-diyl dibenzoate
Property Insights of (7s,8s)-7,8,9,10-Tetrahydrobenzo[f]quinoline-7,8-diyl dibenzoate
The XLogP value of 5.6 indicates that (7s,8s)-7,8,9,10-Tetrahydrobenzo[f]quinoline-7,8-diyl dibenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 65.5 Ų falls within the moderate polarity range, balancing permeability and solubility for (7s,8s)-7,8,9,10-Tetrahydrobenzo[f]quinoline-7,8-diyl dibenzoate. Following Lipinski's Rule of Five, (7s,8s)-7,8,9,10-Tetrahydrobenzo[f]quinoline-7,8-diyl dibenzoate 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 (7s,8s)-7,8,9,10-Tetrahydrobenzo[f]quinoline-7,8-diyl dibenzoate?
The CAS number of (7s,8s)-7,8,9,10-Tetrahydrobenzo[f]quinoline-7,8-diyl dibenzoate is 111897-98-4.
What is the molecular formula of (7s,8s)-7,8,9,10-Tetrahydrobenzo[f]quinoline-7,8-diyl dibenzoate?
The molecular formula of (7s,8s)-7,8,9,10-Tetrahydrobenzo[f]quinoline-7,8-diyl dibenzoate is C27H21NO4.
What is the molecular weight of (7s,8s)-7,8,9,10-Tetrahydrobenzo[f]quinoline-7,8-diyl dibenzoate?
The molecular weight of (7s,8s)-7,8,9,10-Tetrahydrobenzo[f]quinoline-7,8-diyl dibenzoate is 423.15 g/mol.
Where can I buy (7s,8s)-7,8,9,10-Tetrahydrobenzo[f]quinoline-7,8-diyl dibenzoate?
You can request a quote for (7s,8s)-7,8,9,10-Tetrahydrobenzo[f]quinoline-7,8-diyl dibenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (7s,8s)-7,8,9,10-Tetrahydrobenzo[f]quinoline-7,8-diyl dibenzoate?
Yes, KEHONG BIO provides custom synthesis services for (7s,8s)-7,8,9,10-Tetrahydrobenzo[f]quinoline-7,8-diyl dibenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.