1,3,2-Oxazaphospholidine, 2-(4-bromo-2-chlorophenoxy)-3,4-dimethyl-5-phenyl-, 2-sulfide, (2alpha,4alpha,5alpha)-
TL;DR: 1,3,2-Oxazaphospholidine, 2-(4-bromo-2-chlorophenoxy)-3,4-dimethyl-5-phenyl-, 2-sulfide, (2alpha,4alpha,5alpha)- (CAS 81116-97-4) is a chemical compound with molecular formula C16H16BrClNO2PS and molecular weight 430.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2R,4R,5S)-2-(4-bromo-2-chlorophenoxy)-3,4-dimethyl-5-phenyl-2-sulfanylidene-1,3,2λ5-oxazaphospholidine
Also Known As: 1,3,2-Oxazaphospholidine, 2-(4-bromo-2-chlorophenoxy)-3,4-dimethyl-5-phenyl-, 2-sulfide, (2alpha,4alpha,5alpha)-, (2R,4R,5S)-2-(4-Bromo-2-chlorophenoxy)-3,4-dimethyl-5-phenyl-1,3,2lambda~5~-oxazaphospholidine-2-thione
| Molecular Formula | C16H16BrClNO2PS |
|---|---|
| Molecular Weight | 430.95 g/mol |
| LogP | 5.7976 |
| Topological Polar Surface Area | 21.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 430.95114 |
| Heavy Atoms | 23 |
| Complexity | 761.00037 |
Chemical Identifiers
| CAS Number | 81116-97-4 |
|---|---|
| SMILES | C[C@@H]1[C@@H](O[P@](=S)(N1C)OC2=C(C=C(C=C2)Br)Cl)C3=CC=CC=C3 |
Product Overview
1,3,2-Oxazaphospholidine, 2-(4-bromo-2-chlorophenoxy)-3,4-dimethyl-5-phenyl-, 2-sulfide, (2alpha,4alpha,5alpha)- (CAS 81116-97-4), with molecular formula C16H16BrClNO2PS and molecular weight 430.95 g/mol. IUPAC: (2R,4R,5S)-2-(4-bromo-2-chlorophenoxy)-3,4-dimethyl-5-phenyl-2-sulfanylidene-1,3,2λ5-oxazaphospholidine.
Chemical Property Profile of 1,3,2-Oxazaphospholidine, 2-(4-bromo-2-chlorophenoxy)-3,4-dimethyl-5-phenyl-, 2-sulfide, (2alpha,4alpha,5alpha)-
Property Insights of 1,3,2-Oxazaphospholidine, 2-(4-bromo-2-chlorophenoxy)-3,4-dimethyl-5-phenyl-, 2-sulfide, (2alpha,4alpha,5alpha)-
The XLogP value of 5.7976 indicates that 1,3,2-Oxazaphospholidine, 2-(4-bromo-2-chlorophenoxy)-3,4-dimethyl-5-phenyl-, 2-sulfide, (2alpha,4alpha,5alpha)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 21.7 Ų, 1,3,2-Oxazaphospholidine, 2-(4-bromo-2-chlorophenoxy)-3,4-dimethyl-5-phenyl-, 2-sulfide, (2alpha,4alpha,5alpha)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3,2-Oxazaphospholidine, 2-(4-bromo-2-chlorophenoxy)-3,4-dimethyl-5-phenyl-, 2-sulfide, (2alpha,4alpha,5alpha)- has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1,3,2-Oxazaphospholidine, 2-(4-bromo-2-chlorophenoxy)-3,4-dimethyl-5-phenyl-, 2-sulfide, (2alpha,4alpha,5alpha)-?
The CAS number of 1,3,2-Oxazaphospholidine, 2-(4-bromo-2-chlorophenoxy)-3,4-dimethyl-5-phenyl-, 2-sulfide, (2alpha,4alpha,5alpha)- is 81116-97-4.
What is the molecular formula of 1,3,2-Oxazaphospholidine, 2-(4-bromo-2-chlorophenoxy)-3,4-dimethyl-5-phenyl-, 2-sulfide, (2alpha,4alpha,5alpha)-?
The molecular formula of 1,3,2-Oxazaphospholidine, 2-(4-bromo-2-chlorophenoxy)-3,4-dimethyl-5-phenyl-, 2-sulfide, (2alpha,4alpha,5alpha)- is C16H16BrClNO2PS.
What is the molecular weight of 1,3,2-Oxazaphospholidine, 2-(4-bromo-2-chlorophenoxy)-3,4-dimethyl-5-phenyl-, 2-sulfide, (2alpha,4alpha,5alpha)-?
The molecular weight of 1,3,2-Oxazaphospholidine, 2-(4-bromo-2-chlorophenoxy)-3,4-dimethyl-5-phenyl-, 2-sulfide, (2alpha,4alpha,5alpha)- is 430.95 g/mol.
Where can I buy 1,3,2-Oxazaphospholidine, 2-(4-bromo-2-chlorophenoxy)-3,4-dimethyl-5-phenyl-, 2-sulfide, (2alpha,4alpha,5alpha)-?
You can request a quote for 1,3,2-Oxazaphospholidine, 2-(4-bromo-2-chlorophenoxy)-3,4-dimethyl-5-phenyl-, 2-sulfide, (2alpha,4alpha,5alpha)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3,2-Oxazaphospholidine, 2-(4-bromo-2-chlorophenoxy)-3,4-dimethyl-5-phenyl-, 2-sulfide, (2alpha,4alpha,5alpha)-?
Yes, KEHONG BIO provides custom synthesis services for 1,3,2-Oxazaphospholidine, 2-(4-bromo-2-chlorophenoxy)-3,4-dimethyl-5-phenyl-, 2-sulfide, (2alpha,4alpha,5alpha)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.