TimTec1_001356
TL;DR: TimTec1_001356 (CAS 329078-89-9) is a chemical compound with molecular formula C14H10ClF3N2O2S and molecular weight 362.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[4-chloro-3-(trifluoromethyl)phenyl]-2-(furan-2-ylmethylamino)-2-sulfanylideneacetamide
Also Known As: TimTec1_001356, N-[4-chloro-3-(trifluoromethyl)phenyl]-2-[(2-furylmethyl)amino]-2-thioxoacetamide, AA-768/31128002, BRD-K61923482-001-01-9, N-[4-chloro-3-(trifluoromethyl)phenyl]-2-(furan-2-ylmethylamino)-2-sulfanylideneacetamide
| Molecular Formula | C14H10ClF3N2O2S |
|---|---|
| Molecular Weight | 362.01 g/mol |
| LogP | 4.0075 |
| Topological Polar Surface Area | 54.27 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 362.01038 |
| Heavy Atoms | 23 |
| Complexity | 717.3076 |
Chemical Identifiers
| CAS Number | 329078-89-9 |
|---|---|
| SMILES | C1=COC(=C1)CNC(=S)C(=O)NC2=CC(=C(C=C2)Cl)C(F)(F)F |
Product Overview
TimTec1_001356 (CAS 329078-89-9), with molecular formula C14H10ClF3N2O2S and molecular weight 362.01 g/mol. IUPAC: N-[4-chloro-3-(trifluoromethyl)phenyl]-2-(furan-2-ylmethylamino)-2-sulfanylideneacetamide.
Chemical Property Profile of TimTec1_001356
Property Insights of TimTec1_001356
The XLogP value of 4.0075 indicates that TimTec1_001356 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.27 Ų, TimTec1_001356 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, TimTec1_001356 has 2 hydrogen bond donor(s) and 3 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_001356?
The CAS number of TimTec1_001356 is 329078-89-9.
What is the molecular formula of TimTec1_001356?
The molecular formula of TimTec1_001356 is C14H10ClF3N2O2S.
What is the molecular weight of TimTec1_001356?
The molecular weight of TimTec1_001356 is 362.01 g/mol.
Where can I buy TimTec1_001356?
You can request a quote for TimTec1_001356 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for TimTec1_001356?
Yes, KEHONG BIO provides custom synthesis services for TimTec1_001356 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.