1,2,4,3,5-Dithiazadiborolidine, 3,5-dimethyl-
TL;DR: 1,2,4,3,5-Dithiazadiborolidine, 3,5-dimethyl- (CAS 57877-87-9) is a chemical compound with molecular formula C2H7B2NS2 and molecular weight 131.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,5-dimethyl-1,2,4,3,5-dithiazadiborolidine
Also Known As: 1,2,4,3,5-Dithiazadiborolidine, 3,5-dimethyl-, 3,5-dimethyl-1,2,4,3,5-dithiazadiborolidine, 1,2,4,3,5-Dithiazadiborolidine,3,5-dimethyl-
| Molecular Formula | C2H7B2NS2 |
|---|---|
| Molecular Weight | 131.02 g/mol |
| LogP | 1.207 |
| Topological Polar Surface Area | 62.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 131.0206 |
| Heavy Atoms | 7 |
| Complexity | 62.0 |
Chemical Identifiers
| CAS Number | 57877-87-9 |
|---|---|
| SMILES | B1(NB(SS1)C)C |
| InChIKey | XAYGORQZMYRTRR-UHFFFAOYSA-N |
Product Overview
1,2,4,3,5-Dithiazadiborolidine, 3,5-dimethyl- (CAS 57877-87-9), with molecular formula C2H7B2NS2 and molecular weight 131.02 g/mol. IUPAC: 3,5-dimethyl-1,2,4,3,5-dithiazadiborolidine.
Chemical Property Profile of 1,2,4,3,5-Dithiazadiborolidine, 3,5-dimethyl-
Property Insights of 1,2,4,3,5-Dithiazadiborolidine, 3,5-dimethyl-
The XLogP value of 1.207 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,2,4,3,5-Dithiazadiborolidine, 3,5-dimethyl-. The TPSA of 62.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,2,4,3,5-Dithiazadiborolidine, 3,5-dimethyl-. Following Lipinski's Rule of Five, 1,2,4,3,5-Dithiazadiborolidine, 3,5-dimethyl- has 1 hydrogen bond donor(s) and 3 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 1,2,4,3,5-Dithiazadiborolidine, 3,5-dimethyl-?
The CAS number of 1,2,4,3,5-Dithiazadiborolidine, 3,5-dimethyl- is 57877-87-9.
What is the molecular formula of 1,2,4,3,5-Dithiazadiborolidine, 3,5-dimethyl-?
The molecular formula of 1,2,4,3,5-Dithiazadiborolidine, 3,5-dimethyl- is C2H7B2NS2.
What is the molecular weight of 1,2,4,3,5-Dithiazadiborolidine, 3,5-dimethyl-?
The molecular weight of 1,2,4,3,5-Dithiazadiborolidine, 3,5-dimethyl- is 131.02 g/mol.
Where can I buy 1,2,4,3,5-Dithiazadiborolidine, 3,5-dimethyl-?
You can request a quote for 1,2,4,3,5-Dithiazadiborolidine, 3,5-dimethyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,2,4,3,5-Dithiazadiborolidine, 3,5-dimethyl-?
Yes, KEHONG BIO provides custom synthesis services for 1,2,4,3,5-Dithiazadiborolidine, 3,5-dimethyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.