2H-Benzimidazole-2-thione, 1,3-dihydro-1,3-bis((diethylamino)methyl)-4-nitro-
TL;DR: 2H-Benzimidazole-2-thione, 1,3-dihydro-1,3-bis((diethylamino)methyl)-4-nitro- (CAS 112094-08-3) is a chemical compound with molecular formula C17H27N5O2S and molecular weight 365.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3-bis(diethylaminomethyl)-4-nitrobenzimidazole-2-thione
Also Known As: 2H-Benzimidazole-2-thione, 1,3-dihydro-1,3-bis((diethylamino)methyl)-4-nitro-, 1,3-Dihydro-1,3-bis((diethylamino)methyl)-4-nitro-2H-benzimidazole-2-thione, 1,3-bis(diethylaminomethyl)-4-nitrobenzimidazole-2-thione, 1,3-Bis[(diethylamino)methyl]-4-nitro-1,3-dihydro-2H-1,3-benzimidazole-2-thione, RefChem:268563
| Molecular Formula | C17H27N5O2S |
|---|---|
| Molecular Weight | 365.19 g/mol |
| LogP | 3.67909 |
| Topological Polar Surface Area | 59.48 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 365.18854 |
| Heavy Atoms | 25 |
| Complexity | 790.1675 |
Chemical Identifiers
| CAS Number | 112094-08-3 |
|---|---|
| SMILES | CCN(CC)CN1C2=C(C(=CC=C2)[N+](=O)[O-])N(C1=S)CN(CC)CC |
Product Overview
2H-Benzimidazole-2-thione, 1,3-dihydro-1,3-bis((diethylamino)methyl)-4-nitro- (CAS 112094-08-3), with molecular formula C17H27N5O2S and molecular weight 365.19 g/mol. IUPAC: 1,3-bis(diethylaminomethyl)-4-nitrobenzimidazole-2-thione.
Chemical Property Profile of 2H-Benzimidazole-2-thione, 1,3-dihydro-1,3-bis((diethylamino)methyl)-4-nitro-
Property Insights of 2H-Benzimidazole-2-thione, 1,3-dihydro-1,3-bis((diethylamino)methyl)-4-nitro-
The XLogP value of 3.67909 indicates that 2H-Benzimidazole-2-thione, 1,3-dihydro-1,3-bis((diethylamino)methyl)-4-nitro- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.48 Ų, 2H-Benzimidazole-2-thione, 1,3-dihydro-1,3-bis((diethylamino)methyl)-4-nitro- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2H-Benzimidazole-2-thione, 1,3-dihydro-1,3-bis((diethylamino)methyl)-4-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 2H-Benzimidazole-2-thione, 1,3-dihydro-1,3-bis((diethylamino)methyl)-4-nitro-?
The CAS number of 2H-Benzimidazole-2-thione, 1,3-dihydro-1,3-bis((diethylamino)methyl)-4-nitro- is 112094-08-3.
What is the molecular formula of 2H-Benzimidazole-2-thione, 1,3-dihydro-1,3-bis((diethylamino)methyl)-4-nitro-?
The molecular formula of 2H-Benzimidazole-2-thione, 1,3-dihydro-1,3-bis((diethylamino)methyl)-4-nitro- is C17H27N5O2S.
What is the molecular weight of 2H-Benzimidazole-2-thione, 1,3-dihydro-1,3-bis((diethylamino)methyl)-4-nitro-?
The molecular weight of 2H-Benzimidazole-2-thione, 1,3-dihydro-1,3-bis((diethylamino)methyl)-4-nitro- is 365.19 g/mol.
Where can I buy 2H-Benzimidazole-2-thione, 1,3-dihydro-1,3-bis((diethylamino)methyl)-4-nitro-?
You can request a quote for 2H-Benzimidazole-2-thione, 1,3-dihydro-1,3-bis((diethylamino)methyl)-4-nitro- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2H-Benzimidazole-2-thione, 1,3-dihydro-1,3-bis((diethylamino)methyl)-4-nitro-?
Yes, KEHONG BIO provides custom synthesis services for 2H-Benzimidazole-2-thione, 1,3-dihydro-1,3-bis((diethylamino)methyl)-4-nitro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.