TimTec1_007628
TL;DR: TimTec1_007628 (CAS 625375-46-4) is a chemical compound with molecular formula C20H18F3NO5 and molecular weight 409.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
propan-2-yl 2-amino-7-methyl-5-oxo-4-[4-(trifluoromethyl)phenyl]-4H-pyrano[3,2-c]pyran-3-carboxylate
Also Known As: TimTec1_007628, BAS 07418068, IDI1_033282, propan-2-yl 2-amino-7-methyl-5-oxo-4-[4-(trifluoromethyl)phenyl]-4H,5H-pyrano[3,2-c]pyran-3-carboxylate, propan-2-yl 2-amino-7-methyl-5-oxo-4-[4-(trifluoromethyl)phenyl]-4H-pyrano[3,2-c]pyran-3-carboxylate
| Molecular Formula | C20H18F3NO5 |
|---|---|
| Molecular Weight | 409.11 g/mol |
| LogP | 3.61322 |
| Topological Polar Surface Area | 91.76 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 409.1137 |
| Heavy Atoms | 29 |
| Complexity | 1035.5627 |
Chemical Identifiers
| CAS Number | 625375-46-4 |
|---|---|
| SMILES | CC1=CC2=C(C(C(=C(O2)N)C(=O)OC(C)C)C3=CC=C(C=C3)C(F)(F)F)C(=O)O1 |
Product Overview
TimTec1_007628 (CAS 625375-46-4), with molecular formula C20H18F3NO5 and molecular weight 409.11 g/mol. IUPAC: propan-2-yl 2-amino-7-methyl-5-oxo-4-[4-(trifluoromethyl)phenyl]-4H-pyrano[3,2-c]pyran-3-carboxylate.
Chemical Property Profile of TimTec1_007628
Property Insights of TimTec1_007628
The XLogP value of 3.61322 indicates that TimTec1_007628 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 91.76 Ų falls within the moderate polarity range, balancing permeability and solubility for TimTec1_007628. Following Lipinski's Rule of Five, TimTec1_007628 has 1 hydrogen bond donor(s) and 6 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_007628?
The CAS number of TimTec1_007628 is 625375-46-4.
What is the molecular formula of TimTec1_007628?
The molecular formula of TimTec1_007628 is C20H18F3NO5.
What is the molecular weight of TimTec1_007628?
The molecular weight of TimTec1_007628 is 409.11 g/mol.
Where can I buy TimTec1_007628?
You can request a quote for TimTec1_007628 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for TimTec1_007628?
Yes, KEHONG BIO provides custom synthesis services for TimTec1_007628 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.