TimTec1_005375
TL;DR: TimTec1_005375 (CAS 324058-51-7) is a chemical compound with molecular formula C19H17ClF3NO4 and molecular weight 415.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5-methyl-2-propan-2-ylphenyl) N-[5-chloro-2-(trifluoromethyl)-1,3-benzodioxol-2-yl]carbamate
Also Known As: TimTec1_005375, F1023-0136, BRD-A67338382-001-02-5, 5-methyl-2-(propan-2-yl)phenyl N-[5-chloro-2-(trifluoromethyl)-2H-1,3-benzodioxol-2-yl]carbamate, (5-methyl-2-propan-2-ylphenyl) N-[5-chloro-2-(trifluoromethyl)-1,3-benzodioxol-2-yl]carbamate
| Molecular Formula | C19H17ClF3NO4 |
|---|---|
| Molecular Weight | 415.08 g/mol |
| LogP | 5.54772 |
| Topological Polar Surface Area | 56.79 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 415.07983 |
| Heavy Atoms | 28 |
| Complexity | 916.5371 |
Chemical Identifiers
| CAS Number | 324058-51-7 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)C(C)C)OC(=O)NC2(OC3=C(O2)C=C(C=C3)Cl)C(F)(F)F |
Product Overview
TimTec1_005375 (CAS 324058-51-7), with molecular formula C19H17ClF3NO4 and molecular weight 415.08 g/mol. IUPAC: (5-methyl-2-propan-2-ylphenyl) N-[5-chloro-2-(trifluoromethyl)-1,3-benzodioxol-2-yl]carbamate.
Chemical Property Profile of TimTec1_005375
Property Insights of TimTec1_005375
The XLogP value of 5.54772 indicates that TimTec1_005375 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 56.79 Ų, TimTec1_005375 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, TimTec1_005375 has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of TimTec1_005375?
The CAS number of TimTec1_005375 is 324058-51-7.
What is the molecular formula of TimTec1_005375?
The molecular formula of TimTec1_005375 is C19H17ClF3NO4.
What is the molecular weight of TimTec1_005375?
The molecular weight of TimTec1_005375 is 415.08 g/mol.
Where can I buy TimTec1_005375?
You can request a quote for TimTec1_005375 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for TimTec1_005375?
Yes, KEHONG BIO provides custom synthesis services for TimTec1_005375 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.