6-Nitro-2-propan-2-yloxy-1,3-benzothiazole
TL;DR: 6-Nitro-2-propan-2-yloxy-1,3-benzothiazole (CAS 70292-59-0) is a chemical compound with molecular formula C10H10N2O3S and molecular weight 238.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-nitro-2-propan-2-yloxy-1,3-benzothiazole
Also Known As: 2-isopropoxy-6-nitro-benzothiazole, Benzothiazole, 2-(1-methylethoxy)-6-nitro-, 6-nitro-2-propan-2-yloxy-1,3-benzothiazole
| Molecular Formula | C10H10N2O3S |
|---|---|
| Molecular Weight | 238.04 g/mol |
| LogP | 2.9917 |
| Topological Polar Surface Area | 65.26 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 238.04121 |
| Heavy Atoms | 16 |
| Complexity | 535.8437 |
Chemical Identifiers
| CAS Number | 70292-59-0 |
|---|---|
| SMILES | CC(C)OC1=NC2=C(S1)C=C(C=C2)[N+](=O)[O-] |
Product Overview
6-Nitro-2-propan-2-yloxy-1,3-benzothiazole (CAS 70292-59-0), with molecular formula C10H10N2O3S and molecular weight 238.04 g/mol. IUPAC: 6-nitro-2-propan-2-yloxy-1,3-benzothiazole.
Chemical Property Profile of 6-Nitro-2-propan-2-yloxy-1,3-benzothiazole
Property Insights of 6-Nitro-2-propan-2-yloxy-1,3-benzothiazole
The XLogP value of 2.9917 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-Nitro-2-propan-2-yloxy-1,3-benzothiazole. The TPSA of 65.26 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-Nitro-2-propan-2-yloxy-1,3-benzothiazole. Following Lipinski's Rule of Five, 6-Nitro-2-propan-2-yloxy-1,3-benzothiazole has 0 hydrogen bond donor(s) and 5 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 6-Nitro-2-propan-2-yloxy-1,3-benzothiazole?
The CAS number of 6-Nitro-2-propan-2-yloxy-1,3-benzothiazole is 70292-59-0.
What is the molecular formula of 6-Nitro-2-propan-2-yloxy-1,3-benzothiazole?
The molecular formula of 6-Nitro-2-propan-2-yloxy-1,3-benzothiazole is C10H10N2O3S.
What is the molecular weight of 6-Nitro-2-propan-2-yloxy-1,3-benzothiazole?
The molecular weight of 6-Nitro-2-propan-2-yloxy-1,3-benzothiazole is 238.04 g/mol.
Where can I buy 6-Nitro-2-propan-2-yloxy-1,3-benzothiazole?
You can request a quote for 6-Nitro-2-propan-2-yloxy-1,3-benzothiazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Nitro-2-propan-2-yloxy-1,3-benzothiazole?
Yes, KEHONG BIO provides custom synthesis services for 6-Nitro-2-propan-2-yloxy-1,3-benzothiazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.