![1,4-Dimethyl-1,2-dihydrothieno[3,2-d][1,2,3]diazaborinine structure](/static/products/5815/58157-77-0.webp)
1,4-Dimethyl-1,2-dihydrothieno[3,2-d][1,2,3]diazaborinine
TL;DR: 1,4-Dimethyl-1,2-dihydrothieno[3,2-d][1,2,3]diazaborinine (CAS 58157-77-0) is a chemical compound with molecular formula C7H9BN2S and molecular weight 164.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,4-dimethyl-2H-thieno[3,2-d]diazaborinine
Also Known As: 1,4-dimethyl-2H-thieno[3,2-d]diazaborinine, 1,4-Dimethyl-1,2-dihydrothieno[3,2-d][1,2,3]diazaborinine
| Molecular Formula | C7H9BN2S |
|---|---|
| Molecular Weight | 164.06 g/mol |
| LogP | 0.9036 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 164.05795 |
| Heavy Atoms | 11 |
| Complexity | 195.0 |
Chemical Identifiers
| CAS Number | 58157-77-0 |
|---|---|
| SMILES | B1(C2=C(C(=NN1)C)SC=C2)C |
| InChIKey | HNXGXBUGUSDRMV-UHFFFAOYSA-N |
Product Overview
1,4-Dimethyl-1,2-dihydrothieno[3,2-d][1,2,3]diazaborinine (CAS 58157-77-0), with molecular formula C7H9BN2S and molecular weight 164.06 g/mol. IUPAC: 1,4-dimethyl-2H-thieno[3,2-d]diazaborinine.
Chemical Property Profile of 1,4-Dimethyl-1,2-dihydrothieno[3,2-d][1,2,3]diazaborinine
Property Insights of 1,4-Dimethyl-1,2-dihydrothieno[3,2-d][1,2,3]diazaborinine
The XLogP value of 0.9036 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,4-Dimethyl-1,2-dihydrothieno[3,2-d][1,2,3]diazaborinine. With a topological polar surface area (TPSA) of 52.6 Ų, 1,4-Dimethyl-1,2-dihydrothieno[3,2-d][1,2,3]diazaborinine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,4-Dimethyl-1,2-dihydrothieno[3,2-d][1,2,3]diazaborinine 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 1,4-Dimethyl-1,2-dihydrothieno[3,2-d][1,2,3]diazaborinine?
The CAS number of 1,4-Dimethyl-1,2-dihydrothieno[3,2-d][1,2,3]diazaborinine is 58157-77-0.
What is the molecular formula of 1,4-Dimethyl-1,2-dihydrothieno[3,2-d][1,2,3]diazaborinine?
The molecular formula of 1,4-Dimethyl-1,2-dihydrothieno[3,2-d][1,2,3]diazaborinine is C7H9BN2S.
What is the molecular weight of 1,4-Dimethyl-1,2-dihydrothieno[3,2-d][1,2,3]diazaborinine?
The molecular weight of 1,4-Dimethyl-1,2-dihydrothieno[3,2-d][1,2,3]diazaborinine is 164.06 g/mol.
Where can I buy 1,4-Dimethyl-1,2-dihydrothieno[3,2-d][1,2,3]diazaborinine?
You can request a quote for 1,4-Dimethyl-1,2-dihydrothieno[3,2-d][1,2,3]diazaborinine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,4-Dimethyl-1,2-dihydrothieno[3,2-d][1,2,3]diazaborinine?
Yes, KEHONG BIO provides custom synthesis services for 1,4-Dimethyl-1,2-dihydrothieno[3,2-d][1,2,3]diazaborinine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.