Benzimidazole, 2-(2-(diethylamino)ethylthio)-1-methyl-5-nitro-
TL;DR: Benzimidazole, 2-(2-(diethylamino)ethylthio)-1-methyl-5-nitro- (CAS 36911-73-6) is a chemical compound with molecular formula C14H20N4O2S and molecular weight 308.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,N-diethyl-2-(1-methyl-5-nitrobenzimidazol-2-yl)sulfanylethanamine
Also Known As: 5-23-11-00302 (Beilstein Handbook Reference), BENZIMIDAZOLE, 2-(2-(DIETHYLAMINO)ETHYLTHIO)-1-METHYL-5-NITRO-, 1-Methyl-2-(beta-diethylaminoethylthio)-5-nitrobenzimidazole, N,N-diethyl-2-[(1-methyl-5-nitro-1H-benzimidazol-2-yl)sulfanyl]ethanamine, 2-[2-(Diethylamino)ethylthio]-1-methyl-5-nitro-1H-benzimidazole
| Molecular Formula | C14H20N4O2S |
|---|---|
| Molecular Weight | 308.13 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 92.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 308.1307 |
| Heavy Atoms | 21 |
| Complexity | 348.0 |
Chemical Identifiers
| CAS Number | 36911-73-6 |
|---|---|
| SMILES | CCN(CC)CCSC1=NC2=C(N1C)C=CC(=C2)[N+](=O)[O-] |
| InChIKey | PEORAXVROSWSJM-UHFFFAOYSA-N |
Product Overview
Benzimidazole, 2-(2-(diethylamino)ethylthio)-1-methyl-5-nitro- (CAS 36911-73-6), with molecular formula C14H20N4O2S and molecular weight 308.13 g/mol. IUPAC: N,N-diethyl-2-(1-methyl-5-nitrobenzimidazol-2-yl)sulfanylethanamine.
Chemical Property Profile of Benzimidazole, 2-(2-(diethylamino)ethylthio)-1-methyl-5-nitro-
Property Insights of Benzimidazole, 2-(2-(diethylamino)ethylthio)-1-methyl-5-nitro-
The XLogP value of 3.3 indicates that Benzimidazole, 2-(2-(diethylamino)ethylthio)-1-methyl-5-nitro- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 92.2 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzimidazole, 2-(2-(diethylamino)ethylthio)-1-methyl-5-nitro-. Following Lipinski's Rule of Five, Benzimidazole, 2-(2-(diethylamino)ethylthio)-1-methyl-5-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 Benzimidazole, 2-(2-(diethylamino)ethylthio)-1-methyl-5-nitro-?
The CAS number of Benzimidazole, 2-(2-(diethylamino)ethylthio)-1-methyl-5-nitro- is 36911-73-6.
What is the molecular formula of Benzimidazole, 2-(2-(diethylamino)ethylthio)-1-methyl-5-nitro-?
The molecular formula of Benzimidazole, 2-(2-(diethylamino)ethylthio)-1-methyl-5-nitro- is C14H20N4O2S.
What is the molecular weight of Benzimidazole, 2-(2-(diethylamino)ethylthio)-1-methyl-5-nitro-?
The molecular weight of Benzimidazole, 2-(2-(diethylamino)ethylthio)-1-methyl-5-nitro- is 308.13 g/mol.
Where can I buy Benzimidazole, 2-(2-(diethylamino)ethylthio)-1-methyl-5-nitro-?
You can request a quote for Benzimidazole, 2-(2-(diethylamino)ethylthio)-1-methyl-5-nitro- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzimidazole, 2-(2-(diethylamino)ethylthio)-1-methyl-5-nitro-?
Yes, KEHONG BIO provides custom synthesis services for Benzimidazole, 2-(2-(diethylamino)ethylthio)-1-methyl-5-nitro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.