![2-({3-nitrophenyl}sulfonyl)-4-methylthieno[2,3-d][1,2,3]diazaborinin-1(2H)-ol structure](/static/products/3615/36155-72-3.webp)
2-({3-nitrophenyl}sulfonyl)-4-methylthieno[2,3-d][1,2,3]diazaborinin-1(2H)-ol
TL;DR: 2-({3-nitrophenyl}sulfonyl)-4-methylthieno[2,3-d][1,2,3]diazaborinin-1(2H)-ol (CAS 36155-72-3) is a chemical compound with molecular formula C12H10BN3O5S2 and molecular weight 351.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-hydroxy-4-methyl-2-(3-nitrophenyl)sulfonylthieno[2,3-d]diazaborinine
Also Known As: AI-942/13331632, 2-({3-nitrophenyl}sulfonyl)-4-methylthieno[2,3-d][1,2,3]diazaborinin-1(2H)-ol, 1-hydroxy-4-methyl-2-(3-nitrophenyl)sulfonylthieno[2,3-d]diazaborinine
| Molecular Formula | C12H10BN3O5S2 |
|---|---|
| Molecular Weight | 351.02 g/mol |
| LogP | 0.7723 |
| Topological Polar Surface Area | 113.11 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 351.0155 |
| Heavy Atoms | 23 |
| Complexity | 924.2823 |
Chemical Identifiers
| CAS Number | 36155-72-3 |
|---|---|
| SMILES | B1(C2=C(C=CS2)C(=NN1S(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-])C)O |
Product Overview
2-({3-nitrophenyl}sulfonyl)-4-methylthieno[2,3-d][1,2,3]diazaborinin-1(2H)-ol (CAS 36155-72-3), with molecular formula C12H10BN3O5S2 and molecular weight 351.02 g/mol. IUPAC: 1-hydroxy-4-methyl-2-(3-nitrophenyl)sulfonylthieno[2,3-d]diazaborinine.
Chemical Property Profile of 2-({3-nitrophenyl}sulfonyl)-4-methylthieno[2,3-d][1,2,3]diazaborinin-1(2H)-ol
Property Insights of 2-({3-nitrophenyl}sulfonyl)-4-methylthieno[2,3-d][1,2,3]diazaborinin-1(2H)-ol
The XLogP value of 0.7723 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-({3-nitrophenyl}sulfonyl)-4-methylthieno[2,3-d][1,2,3]diazaborinin-1(2H)-ol. The TPSA of 113.11 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-({3-nitrophenyl}sulfonyl)-4-methylthieno[2,3-d][1,2,3]diazaborinin-1(2H)-ol. Following Lipinski's Rule of Five, 2-({3-nitrophenyl}sulfonyl)-4-methylthieno[2,3-d][1,2,3]diazaborinin-1(2H)-ol has 1 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 2-({3-nitrophenyl}sulfonyl)-4-methylthieno[2,3-d][1,2,3]diazaborinin-1(2H)-ol?
The CAS number of 2-({3-nitrophenyl}sulfonyl)-4-methylthieno[2,3-d][1,2,3]diazaborinin-1(2H)-ol is 36155-72-3.
What is the molecular formula of 2-({3-nitrophenyl}sulfonyl)-4-methylthieno[2,3-d][1,2,3]diazaborinin-1(2H)-ol?
The molecular formula of 2-({3-nitrophenyl}sulfonyl)-4-methylthieno[2,3-d][1,2,3]diazaborinin-1(2H)-ol is C12H10BN3O5S2.
What is the molecular weight of 2-({3-nitrophenyl}sulfonyl)-4-methylthieno[2,3-d][1,2,3]diazaborinin-1(2H)-ol?
The molecular weight of 2-({3-nitrophenyl}sulfonyl)-4-methylthieno[2,3-d][1,2,3]diazaborinin-1(2H)-ol is 351.02 g/mol.
Where can I buy 2-({3-nitrophenyl}sulfonyl)-4-methylthieno[2,3-d][1,2,3]diazaborinin-1(2H)-ol?
You can request a quote for 2-({3-nitrophenyl}sulfonyl)-4-methylthieno[2,3-d][1,2,3]diazaborinin-1(2H)-ol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-({3-nitrophenyl}sulfonyl)-4-methylthieno[2,3-d][1,2,3]diazaborinin-1(2H)-ol?
Yes, KEHONG BIO provides custom synthesis services for 2-({3-nitrophenyl}sulfonyl)-4-methylthieno[2,3-d][1,2,3]diazaborinin-1(2H)-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.