SC6CA8T0XU
TL;DR: SC6CA8T0XU (CAS 117211-86-6) is a chemical compound with molecular formula C21H20O8 and molecular weight 400.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(7S,8S)-7-acetyl-8-(3,4,5-trimethoxyphenyl)-7,8-dihydro-[1,3]dioxolo[4,5-g]chromen-6-one
Also Known As: 6H-1,3-Dioxolo(4,5-g)(1)benzopyran-6-one, 7-acetyl-7,8-dihydro-8-(3,4,5-trimethoxyphenyl)-, trans-, 7-Acetyl-7,8-dihydro-8-(3,4,5-trimethoxyphenyl)-6H-1,3-dioxolo(4,5-g)(1)benzopyran-6-one trans-, 7-Acetyl-7,8-dihydro-8-(3,4,5-trimethoxyphenyl)-6H-1,3-dioxolo(4,5-g)(1)benzopyran-6-one, trans-, (7S,8S)-7-acetyl-8-(3,4,5-trimethoxyphenyl)-7,8-dihydro-[1,3]dioxolo[4,5-g]chromen-6-one, (7S,8S)-7-Acetyl-8-(3,4,5-trimethoxyphenyl)-7,8-dihydro-2H,6H-[1,3]dioxolo[4,5-g][1]benzopyran-6-one
| Molecular Formula | C21H20O8 |
|---|---|
| Molecular Weight | 400.12 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 89.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 400.1158 |
| Heavy Atoms | 29 |
| Complexity | 610.0 |
Chemical Identifiers
| CAS Number | 117211-86-6 |
|---|---|
| SMILES | CC(=O)[C@@H]1[C@H](C2=CC3=C(C=C2OC1=O)OCO3)C4=CC(=C(C(=C4)OC)OC)OC |
| InChIKey | CEVCUUKJLCNBFF-MOPGFXCFSA-N |
Product Overview
SC6CA8T0XU (CAS 117211-86-6), with molecular formula C21H20O8 and molecular weight 400.12 g/mol. IUPAC: (7S,8S)-7-acetyl-8-(3,4,5-trimethoxyphenyl)-7,8-dihydro-[1,3]dioxolo[4,5-g]chromen-6-one.
Chemical Property Profile of SC6CA8T0XU
Property Insights of SC6CA8T0XU
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for SC6CA8T0XU. The TPSA of 89.5 Ų falls within the moderate polarity range, balancing permeability and solubility for SC6CA8T0XU. Following Lipinski's Rule of Five, SC6CA8T0XU has 0 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of SC6CA8T0XU?
The CAS number of SC6CA8T0XU is 117211-86-6.
What is the molecular formula of SC6CA8T0XU?
The molecular formula of SC6CA8T0XU is C21H20O8.
What is the molecular weight of SC6CA8T0XU?
The molecular weight of SC6CA8T0XU is 400.12 g/mol.
Where can I buy SC6CA8T0XU?
You can request a quote for SC6CA8T0XU directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for SC6CA8T0XU?
Yes, KEHONG BIO provides custom synthesis services for SC6CA8T0XU and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.