Brn 2181437
TL;DR: Brn 2181437 (CAS 3383-27-5) is a chemical compound with molecular formula C12H19ClNO6PS and molecular weight 371.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[3-chloro-4-(diethylsulfamoyl)phenyl] dimethyl phosphate
Also Known As: 1,4-bis-chloromethyl-2,3-dimethyl-naphthalene, 2-Chloro-N,N-diethyl-4-hydroxybenzenesulfonamide dimethyl phosphate, 3-Chloro-4-(diethylsulfamoyl)phenyl dimethyl phosphate, [3-chloro-4-(diethylsulfamoyl)phenyl] dimethyl phosphate, Phosphoric acid, dimethyl ester, ester with 2-chloro-N,N-diethyl-4-hydroxybenzenesulfonamide
| Molecular Formula | C12H19ClNO6PS |
|---|---|
| Molecular Weight | 371.04 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 90.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 371.03592 |
| Heavy Atoms | 22 |
| Complexity | 484.0 |
Chemical Identifiers
| CAS Number | 3383-27-5 |
|---|---|
| SMILES | CCN(CC)S(=O)(=O)C1=C(C=C(C=C1)OP(=O)(OC)OC)Cl |
| InChIKey | VHLVOVNFLWMVOE-UHFFFAOYSA-N |
Product Overview
Brn 2181437 (CAS 3383-27-5), with molecular formula C12H19ClNO6PS and molecular weight 371.04 g/mol. IUPAC: [3-chloro-4-(diethylsulfamoyl)phenyl] dimethyl phosphate.
Chemical Property Profile of Brn 2181437
Property Insights of Brn 2181437
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Brn 2181437. The TPSA of 90.5 Ų falls within the moderate polarity range, balancing permeability and solubility for Brn 2181437. Following Lipinski's Rule of Five, Brn 2181437 has 0 hydrogen bond donor(s) and 7 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 Brn 2181437?
The CAS number of Brn 2181437 is 3383-27-5.
What is the molecular formula of Brn 2181437?
The molecular formula of Brn 2181437 is C12H19ClNO6PS.
What is the molecular weight of Brn 2181437?
The molecular weight of Brn 2181437 is 371.04 g/mol.
Where can I buy Brn 2181437?
You can request a quote for Brn 2181437 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Brn 2181437?
Yes, KEHONG BIO provides custom synthesis services for Brn 2181437 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.