A3937/0167613
TL;DR: A3937/0167613 (CAS 193286-58-7) is a chemical compound with molecular formula C19H11F4N3O2S and molecular weight 421.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 1-(1,3-benzothiazol-2-yl)-5-(2,3,4,5-tetrafluorophenyl)pyrazole-4-carboxylate
Also Known As: A3937/0167613, ethyl 1-(1,3-benzothiazol-2-yl)-5-(2,3,4,5-tetrafluorophenyl)-1H-pyrazole-4-carboxylate, ethyl 1-(benzo[d]thiazol-2-yl)-5-(2,3,4,5-tetrafluorophenyl)-1H-pyrazole-4-carboxylate, ethyl 1-(1,3-benzothiazol-2-yl)-5-(2,3,4,5-tetrafluorophenyl)pyrazole-4-carboxylate
| Molecular Formula | C19H11F4N3O2S |
|---|---|
| Molecular Weight | 421.05 g/mol |
| LogP | 4.8821 |
| Topological Polar Surface Area | 57.01 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 421.0508 |
| Heavy Atoms | 29 |
| Complexity | 1218.962 |
Chemical Identifiers
| CAS Number | 193286-58-7 |
|---|---|
| SMILES | CCOC(=O)C1=C(N(N=C1)C2=NC3=CC=CC=C3S2)C4=CC(=C(C(=C4F)F)F)F |
Product Overview
A3937/0167613 (CAS 193286-58-7), with molecular formula C19H11F4N3O2S and molecular weight 421.05 g/mol. IUPAC: ethyl 1-(1,3-benzothiazol-2-yl)-5-(2,3,4,5-tetrafluorophenyl)pyrazole-4-carboxylate.
Chemical Property Profile of A3937/0167613
Property Insights of A3937/0167613
The XLogP value of 4.8821 indicates that A3937/0167613 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.01 Ų, A3937/0167613 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, A3937/0167613 has 0 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 A3937/0167613?
The CAS number of A3937/0167613 is 193286-58-7.
What is the molecular formula of A3937/0167613?
The molecular formula of A3937/0167613 is C19H11F4N3O2S.
What is the molecular weight of A3937/0167613?
The molecular weight of A3937/0167613 is 421.05 g/mol.
Where can I buy A3937/0167613?
You can request a quote for A3937/0167613 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A3937/0167613?
Yes, KEHONG BIO provides custom synthesis services for A3937/0167613 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.