![4-(nitro)thieno[3,2-d][1,2,3]diazaborinin-1(2H)-ol structure](/static/products/1343/13435-83-1.webp)
4-(nitro)thieno[3,2-d][1,2,3]diazaborinin-1(2H)-ol
TL;DR: 4-(nitro)thieno[3,2-d][1,2,3]diazaborinin-1(2H)-ol (CAS 13435-83-1) is a chemical compound with molecular formula C5H4BN3O3S and molecular weight 197.00664 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-hydroxy-4-nitro-2H-thieno[3,2-d]diazaborinine
Also Known As: 4-(nitro)thieno[3,2-d][1,2,3]diazaborinin-1(2H)-ol, 1-hydroxy-4-nitro-2H-thieno[3,2-d]diazaborinine, AI-942/13331006, 4-nitro-2H-thieno[3,2-d][1,2,3]diazaborinin-1-ol, 4-Nitrothieno[3,2-d][1,2,3]diazaborinin-1(2H)-ol
Technical Specifications
| Molecular Formula | C5H4BN3O3S |
| Molecular Weight | 197.00664 g/mol |
| XLogP | -1.0229 |
| Topological Polar Surface Area (TPSA) | 119.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 0 |
| Exact Mass | 197.00664 Da |
| Heavy Atoms | 13 |
| Complexity | 268.0 |
| SMILES | B1(C2=C(C(=NN1)[N+](=O)[O-])SC=C2)O |
| InChIKey | QJXYGTBYSLNEGD-UHFFFAOYSA-N |
Chemical Property Profile of 4-(nitro)thieno[3,2-d][1,2,3]diazaborinin-1(2H)-ol
Property Insights of 4-(nitro)thieno[3,2-d][1,2,3]diazaborinin-1(2H)-ol
The XLogP value of -1.0229 indicates that 4-(nitro)thieno[3,2-d][1,2,3]diazaborinin-1(2H)-ol is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 119.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(nitro)thieno[3,2-d][1,2,3]diazaborinin-1(2H)-ol. Following Lipinski's Rule of Five, 4-(nitro)thieno[3,2-d][1,2,3]diazaborinin-1(2H)-ol has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 4-(nitro)thieno[3,2-d][1,2,3]diazaborinin-1(2H)-ol?
The CAS number of 4-(nitro)thieno[3,2-d][1,2,3]diazaborinin-1(2H)-ol is 13435-83-1.
What is the molecular formula of 4-(nitro)thieno[3,2-d][1,2,3]diazaborinin-1(2H)-ol?
The molecular formula of 4-(nitro)thieno[3,2-d][1,2,3]diazaborinin-1(2H)-ol is C5H4BN3O3S.
What is the molecular weight of 4-(nitro)thieno[3,2-d][1,2,3]diazaborinin-1(2H)-ol?
The molecular weight of 4-(nitro)thieno[3,2-d][1,2,3]diazaborinin-1(2H)-ol is 197.00664 g/mol.
Where can I buy 4-(nitro)thieno[3,2-d][1,2,3]diazaborinin-1(2H)-ol?
You can request a quote for 4-(nitro)thieno[3,2-d][1,2,3]diazaborinin-1(2H)-ol directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-(nitro)thieno[3,2-d][1,2,3]diazaborinin-1(2H)-ol?
Yes, CoreyChem provides custom synthesis services for 4-(nitro)thieno[3,2-d][1,2,3]diazaborinin-1(2H)-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.