Einecs 256-855-7
TL;DR: Einecs 256-855-7 (CAS 50930-44-4) is a chemical compound with molecular formula C12H19N3O3S and molecular weight 285.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,2-dioxo-3-propan-2-yl-1H-2λ6,1,3-benzothiadiazin-4-one;N-methylmethanamine
Also Known As: EINECS 256-855-7, 2,2-dioxo-3-propan-2-yl-1H-2, 3-(Isopropyl)-1H-2,1,3-benzothiadiazin-4(3H)-one 2,2-dioxide, compound with dimethylamine (1:1), 3-(Isopropyl)-1H-2,1,3-benzothiadiazin-4(3H)-one 2,2-dioxide,compound with dimethylamine(1:1), 3-(Propan-2-yl)-2lambda~6~,1,3-benzothiadiazine-2,2,4(1H,3H)-trione--N-methylmethanamine (1/1)
| Molecular Formula | C12H19N3O3S |
|---|---|
| Molecular Weight | 285.11 g/mol |
| LogP | 1.0431 |
| Topological Polar Surface Area | 78.51 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 285.11472 |
| Heavy Atoms | 19 |
| Complexity | 555.09296 |
Chemical Identifiers
| CAS Number | 50930-44-4 |
|---|---|
| SMILES | CC(C)N1C(=O)C2=CC=CC=C2NS1(=O)=O.CNC |
Product Overview
Einecs 256-855-7 (CAS 50930-44-4), with molecular formula C12H19N3O3S and molecular weight 285.11 g/mol. IUPAC: 2,2-dioxo-3-propan-2-yl-1H-2λ6,1,3-benzothiadiazin-4-one;N-methylmethanamine.
Chemical Property Profile of Einecs 256-855-7
Property Insights of Einecs 256-855-7
The XLogP value of 1.0431 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Einecs 256-855-7. The TPSA of 78.51 Ų falls within the moderate polarity range, balancing permeability and solubility for Einecs 256-855-7. Following Lipinski's Rule of Five, Einecs 256-855-7 has 2 hydrogen bond donor(s) and 4 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 Einecs 256-855-7?
The CAS number of Einecs 256-855-7 is 50930-44-4.
What is the molecular formula of Einecs 256-855-7?
The molecular formula of Einecs 256-855-7 is C12H19N3O3S.
What is the molecular weight of Einecs 256-855-7?
The molecular weight of Einecs 256-855-7 is 285.11 g/mol.
Where can I buy Einecs 256-855-7?
You can request a quote for Einecs 256-855-7 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Einecs 256-855-7?
Yes, KEHONG BIO provides custom synthesis services for Einecs 256-855-7 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.