TimTec1_002989
TL;DR: TimTec1_002989 (CAS 431995-16-3) is a chemical compound with molecular formula C19H20Cl2N2O3S and molecular weight 426.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(2,4-dichlorophenyl)methyl]-N-(2-oxo-2-pyrrolidin-1-ylethyl)benzenesulfonamide
Also Known As: TimTec1_002989, AP-828/40963815, BRD-K75993945-001-01-7, N-[(2,4-dichlorophenyl)methyl]-N-(2-oxo-2-pyrrolidin-1-ylethyl)benzenesulfonamide, N-(2,4-dichlorobenzyl)-N-[2-oxo-2-(1-pyrrolidinyl)ethyl]benzenesulfonamide
| Molecular Formula | C19H20Cl2N2O3S |
|---|---|
| Molecular Weight | 426.06 g/mol |
| LogP | 3.8067 |
| Topological Polar Surface Area | 57.69 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 426.05716 |
| Heavy Atoms | 27 |
| Complexity | 913.80695 |
Chemical Identifiers
| CAS Number | 431995-16-3 |
|---|---|
| SMILES | C1CCN(C1)C(=O)CN(CC2=C(C=C(C=C2)Cl)Cl)S(=O)(=O)C3=CC=CC=C3 |
Product Overview
TimTec1_002989 (CAS 431995-16-3), with molecular formula C19H20Cl2N2O3S and molecular weight 426.06 g/mol. IUPAC: N-[(2,4-dichlorophenyl)methyl]-N-(2-oxo-2-pyrrolidin-1-ylethyl)benzenesulfonamide.
Chemical Property Profile of TimTec1_002989
Property Insights of TimTec1_002989
The XLogP value of 3.8067 indicates that TimTec1_002989 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.69 Ų, TimTec1_002989 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, TimTec1_002989 has 0 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_002989?
The CAS number of TimTec1_002989 is 431995-16-3.
What is the molecular formula of TimTec1_002989?
The molecular formula of TimTec1_002989 is C19H20Cl2N2O3S.
What is the molecular weight of TimTec1_002989?
The molecular weight of TimTec1_002989 is 426.06 g/mol.
Where can I buy TimTec1_002989?
You can request a quote for TimTec1_002989 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for TimTec1_002989?
Yes, KEHONG BIO provides custom synthesis services for TimTec1_002989 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.