BAS 00243474
TL;DR: BAS 00243474 (CAS 330684-11-2) is a chemical compound with molecular formula C13H5F11N2O2S and molecular weight 461.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1,3-benzothiazol-2-yl)-2,3,3,3-tetrafluoro-2-(1,1,2,2,3,3,3-heptafluoropropoxy)propanamide
Also Known As: BAS 00243474, N-Benzothiazol-2-yl-2,3,3,3-tetrafluoro-2-heptafluoropropyloxy-propionamide, N-(benzo[d]thiazol-2-yl)-2,3,3,3-tetrafluoro-2-(perfluoropropoxy)propanamide, N-(1,3-benzothiazol-2-yl)-2,3,3,3-tetrafluoro-2-(1,1,2,2,3,3,3-heptafluoropropoxy)propanamide, N-[(2Z)-1,3-benzothiazol-2(3H)-ylidene]-2,3,3,3-tetrafluoro-2-(heptafluoropropoxy)propanamide
| Molecular Formula | C13H5F11N2O2S |
|---|---|
| Molecular Weight | 461.99 g/mol |
| LogP | 5.2699 |
| Topological Polar Surface Area | 51.22 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 461.9896 |
| Heavy Atoms | 29 |
| Complexity | 875.0327 |
Chemical Identifiers
| CAS Number | 330684-11-2 |
|---|---|
| SMILES | C1=CC=C2C(=C1)N=C(S2)NC(=O)C(C(F)(F)F)(OC(C(C(F)(F)F)(F)F)(F)F)F |
Product Overview
BAS 00243474 (CAS 330684-11-2), with molecular formula C13H5F11N2O2S and molecular weight 461.99 g/mol. IUPAC: N-(1,3-benzothiazol-2-yl)-2,3,3,3-tetrafluoro-2-(1,1,2,2,3,3,3-heptafluoropropoxy)propanamide.
Chemical Property Profile of BAS 00243474
Property Insights of BAS 00243474
The XLogP value of 5.2699 indicates that BAS 00243474 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.22 Ų, BAS 00243474 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 00243474 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 BAS 00243474?
The CAS number of BAS 00243474 is 330684-11-2.
What is the molecular formula of BAS 00243474?
The molecular formula of BAS 00243474 is C13H5F11N2O2S.
What is the molecular weight of BAS 00243474?
The molecular weight of BAS 00243474 is 461.99 g/mol.
Where can I buy BAS 00243474?
You can request a quote for BAS 00243474 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00243474?
Yes, KEHONG BIO provides custom synthesis services for BAS 00243474 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.