![2-[(1H-benzimidazol-2-ylmethyl)sulfanyl]-6-nitro-1,3-benzothiazole structure](/static/products/3320/332026-38-7.webp)
2-[(1H-benzimidazol-2-ylmethyl)sulfanyl]-6-nitro-1,3-benzothiazole
TL;DR: 2-[(1H-benzimidazol-2-ylmethyl)sulfanyl]-6-nitro-1,3-benzothiazole (CAS 332026-38-7) is a chemical compound with molecular formula C15H10N4O2S2 and molecular weight 342.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1H-benzimidazol-2-ylmethylsulfanyl)-6-nitro-1,3-benzothiazole
Also Known As: BAS 00829485, BIM-0030495.P001, 2-(benzimidazol-2-ylmethylthio)-6-nitrobenzothiazole, 2-{[(1H-1,3-benzodiazol-2-yl)methyl]sulfanyl}-6-nitro-1,3-benzothiazole, 2-[(1H-benzimidazol-2-ylmethyl)sulfanyl]-6-nitro-1,3-benzothiazole
| Molecular Formula | C15H10N4O2S2 |
|---|---|
| Molecular Weight | 342.02 g/mol |
| LogP | 4.1 |
| Topological Polar Surface Area | 141.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 342.0245 |
| Heavy Atoms | 23 |
| Complexity | 450.0 |
Chemical Identifiers
| CAS Number | 332026-38-7 |
|---|---|
| SMILES | C1=CC=C2C(=C1)NC(=N2)CSC3=NC4=C(S3)C=C(C=C4)[N+](=O)[O-] |
| InChIKey | OKJOBFZKXCEMMI-UHFFFAOYSA-N |
Product Overview
2-[(1H-benzimidazol-2-ylmethyl)sulfanyl]-6-nitro-1,3-benzothiazole (CAS 332026-38-7), with molecular formula C15H10N4O2S2 and molecular weight 342.02 g/mol. IUPAC: 2-(1H-benzimidazol-2-ylmethylsulfanyl)-6-nitro-1,3-benzothiazole.
Chemical Property Profile of 2-[(1H-benzimidazol-2-ylmethyl)sulfanyl]-6-nitro-1,3-benzothiazole
Property Insights of 2-[(1H-benzimidazol-2-ylmethyl)sulfanyl]-6-nitro-1,3-benzothiazole
The XLogP value of 4.1 indicates that 2-[(1H-benzimidazol-2-ylmethyl)sulfanyl]-6-nitro-1,3-benzothiazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 141.0 Ų indicates high polarity, suggesting 2-[(1H-benzimidazol-2-ylmethyl)sulfanyl]-6-nitro-1,3-benzothiazole may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 2-[(1H-benzimidazol-2-ylmethyl)sulfanyl]-6-nitro-1,3-benzothiazole has 1 hydrogen bond donor(s) and 6 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-[(1H-benzimidazol-2-ylmethyl)sulfanyl]-6-nitro-1,3-benzothiazole?
The CAS number of 2-[(1H-benzimidazol-2-ylmethyl)sulfanyl]-6-nitro-1,3-benzothiazole is 332026-38-7.
What is the molecular formula of 2-[(1H-benzimidazol-2-ylmethyl)sulfanyl]-6-nitro-1,3-benzothiazole?
The molecular formula of 2-[(1H-benzimidazol-2-ylmethyl)sulfanyl]-6-nitro-1,3-benzothiazole is C15H10N4O2S2.
What is the molecular weight of 2-[(1H-benzimidazol-2-ylmethyl)sulfanyl]-6-nitro-1,3-benzothiazole?
The molecular weight of 2-[(1H-benzimidazol-2-ylmethyl)sulfanyl]-6-nitro-1,3-benzothiazole is 342.02 g/mol.
Where can I buy 2-[(1H-benzimidazol-2-ylmethyl)sulfanyl]-6-nitro-1,3-benzothiazole?
You can request a quote for 2-[(1H-benzimidazol-2-ylmethyl)sulfanyl]-6-nitro-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 2-[(1H-benzimidazol-2-ylmethyl)sulfanyl]-6-nitro-1,3-benzothiazole?
Yes, KEHONG BIO provides custom synthesis services for 2-[(1H-benzimidazol-2-ylmethyl)sulfanyl]-6-nitro-1,3-benzothiazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.