![Benzothiazole, 2-[(1-methylethyl)thio]-6-nitro- structure](/static/products/3833/38338-27-1.webp)
Benzothiazole, 2-[(1-methylethyl)thio]-6-nitro-
TL;DR: Benzothiazole, 2-[(1-methylethyl)thio]-6-nitro- (CAS 38338-27-1) is a chemical compound with molecular formula C10H10N2O2S2 and molecular weight 254.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-nitro-2-propan-2-ylsulfanyl-1,3-benzothiazole
Also Known As: 2-(isopropylthio)-6-nitro-1,3-benzothiazole, Benzothiazole, 2-[(1-methylethyl)thio]-6-nitro-, 6-nitro-2-propan-2-ylsulfanyl-1,3-benzothiazole, 6-nitro-2-(isopropylsulfanyl)-1,3-benzothiazole, Cambridge id 6006315
| Molecular Formula | C10H10N2O2S2 |
|---|---|
| Molecular Weight | 254.02 g/mol |
| LogP | 3.705 |
| Topological Polar Surface Area | 56.03 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 254.01837 |
| Heavy Atoms | 16 |
| Complexity | 536.5986 |
Chemical Identifiers
| CAS Number | 38338-27-1 |
|---|---|
| SMILES | CC(C)SC1=NC2=C(S1)C=C(C=C2)[N+](=O)[O-] |
Product Overview
Benzothiazole, 2-[(1-methylethyl)thio]-6-nitro- (CAS 38338-27-1), with molecular formula C10H10N2O2S2 and molecular weight 254.02 g/mol. IUPAC: 6-nitro-2-propan-2-ylsulfanyl-1,3-benzothiazole.
Chemical Property Profile of Benzothiazole, 2-[(1-methylethyl)thio]-6-nitro-
Property Insights of Benzothiazole, 2-[(1-methylethyl)thio]-6-nitro-
The XLogP value of 3.705 indicates that Benzothiazole, 2-[(1-methylethyl)thio]-6-nitro- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 56.03 Ų, Benzothiazole, 2-[(1-methylethyl)thio]-6-nitro- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzothiazole, 2-[(1-methylethyl)thio]-6-nitro- 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 Benzothiazole, 2-[(1-methylethyl)thio]-6-nitro-?
The CAS number of Benzothiazole, 2-[(1-methylethyl)thio]-6-nitro- is 38338-27-1.
What is the molecular formula of Benzothiazole, 2-[(1-methylethyl)thio]-6-nitro-?
The molecular formula of Benzothiazole, 2-[(1-methylethyl)thio]-6-nitro- is C10H10N2O2S2.
What is the molecular weight of Benzothiazole, 2-[(1-methylethyl)thio]-6-nitro-?
The molecular weight of Benzothiazole, 2-[(1-methylethyl)thio]-6-nitro- is 254.02 g/mol.
Where can I buy Benzothiazole, 2-[(1-methylethyl)thio]-6-nitro-?
You can request a quote for Benzothiazole, 2-[(1-methylethyl)thio]-6-nitro- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzothiazole, 2-[(1-methylethyl)thio]-6-nitro-?
Yes, KEHONG BIO provides custom synthesis services for Benzothiazole, 2-[(1-methylethyl)thio]-6-nitro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.