TimTec1_005135
TL;DR: TimTec1_005135 (CAS 117211-91-3) is a chemical compound with molecular formula C19H20O5 and molecular weight 328.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-(2-methoxyphenyl)-6,7-dimethyl-7,8-dihydro-[1,3]dioxolo[4,5-g]chromen-6-ol
Also Known As: TimTec1_005135, 7,8-Dihydro-8-(2-methoxyphenyl)-6,7-dimethyl-6H-1,3-dioxolo(4,5-g)(1)benzopyran-6-ol, 6H-1,3-Dioxolo(4,5-g)(1)benzopyran-6-ol, 7,8-dihydro-8-(2-methoxyphenyl)-6,7-dimethyl-, 8-(2-methoxyphenyl)-6,7-dimethyl-7,8-dihydro-[1,3]dioxolo[4,5-g]chromen-6-ol, 8-(2-Methoxyphenyl)-6,7-dimethyl-7,8-dihydro-2H,6H-[1,3]dioxolo[4,5-g][1]benzopyran-6-ol
| Molecular Formula | C19H20O5 |
|---|---|
| Molecular Weight | 328.13 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 57.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 328.13107 |
| Heavy Atoms | 24 |
| Complexity | 457.0 |
Chemical Identifiers
| CAS Number | 117211-91-3 |
|---|---|
| SMILES | CC1C(C2=CC3=C(C=C2OC1(C)O)OCO3)C4=CC=CC=C4OC |
| InChIKey | XXTYTXLSSMUXLK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
TimTec1_005135 (CAS 117211-91-3), with molecular formula C19H20O5 and molecular weight 328.13 g/mol. IUPAC: 8-(2-methoxyphenyl)-6,7-dimethyl-7,8-dihydro-[1,3]dioxolo[4,5-g]chromen-6-ol.
Chemical Property Profile of TimTec1_005135
Property Insights of TimTec1_005135
The XLogP value of 3.6 indicates that TimTec1_005135 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.2 Ų, TimTec1_005135 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, TimTec1_005135 has 1 hydrogen bond donor(s) and 5 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 TimTec1_005135?
The CAS number of TimTec1_005135 is 117211-91-3.
What is the molecular formula of TimTec1_005135?
The molecular formula of TimTec1_005135 is C19H20O5.
What is the molecular weight of TimTec1_005135?
The molecular weight of TimTec1_005135 is 328.13 g/mol.
Where can I buy TimTec1_005135?
You can request a quote for TimTec1_005135 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for TimTec1_005135?
Yes, KEHONG BIO provides custom synthesis services for TimTec1_005135 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.