2H-Benzimidazole-2-thione, 1,3-dihydro-1,3-bis(4-morpholinylmethyl)-4-nitro-
TL;DR: 2H-Benzimidazole-2-thione, 1,3-dihydro-1,3-bis(4-morpholinylmethyl)-4-nitro- (CAS 112094-10-7) is a chemical compound with molecular formula C17H23N5O4S and molecular weight 393.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3-bis(morpholin-4-ylmethyl)-4-nitrobenzimidazole-2-thione
Also Known As: 2H-Benzimidazole-2-thione, 1,3-dihydro-1,3-bis(4-morpholinylmethyl)-4-nitro-, 1,3-Dihydro-1,3-bis(4-morpholinylmethyl)-4-nitro-2H-benzimidazole-2-thione, 1,3-bis(morpholin-4-ylmethyl)-4-nitrobenzimidazole-2-thione, 1,3-Bis[(morpholin-4-yl)methyl]-4-nitro-1,3-dihydro-2H-1,3-benzimidazole-2-thione, RefChem:268568
| Molecular Formula | C17H23N5O4S |
|---|---|
| Molecular Weight | 393.15 g/mol |
| LogP | 1.65989 |
| Topological Polar Surface Area | 77.94 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 393.14706 |
| Heavy Atoms | 27 |
| Complexity | 883.31146 |
Chemical Identifiers
| CAS Number | 112094-10-7 |
|---|---|
| SMILES | C1COCCN1CN2C3=C(C(=CC=C3)[N+](=O)[O-])N(C2=S)CN4CCOCC4 |
Product Overview
2H-Benzimidazole-2-thione, 1,3-dihydro-1,3-bis(4-morpholinylmethyl)-4-nitro- (CAS 112094-10-7), with molecular formula C17H23N5O4S and molecular weight 393.15 g/mol. IUPAC: 1,3-bis(morpholin-4-ylmethyl)-4-nitrobenzimidazole-2-thione.
Chemical Property Profile of 2H-Benzimidazole-2-thione, 1,3-dihydro-1,3-bis(4-morpholinylmethyl)-4-nitro-
Property Insights of 2H-Benzimidazole-2-thione, 1,3-dihydro-1,3-bis(4-morpholinylmethyl)-4-nitro-
The XLogP value of 1.65989 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2H-Benzimidazole-2-thione, 1,3-dihydro-1,3-bis(4-morpholinylmethyl)-4-nitro-. The TPSA of 77.94 Ų falls within the moderate polarity range, balancing permeability and solubility for 2H-Benzimidazole-2-thione, 1,3-dihydro-1,3-bis(4-morpholinylmethyl)-4-nitro-. Following Lipinski's Rule of Five, 2H-Benzimidazole-2-thione, 1,3-dihydro-1,3-bis(4-morpholinylmethyl)-4-nitro- has 0 hydrogen bond donor(s) and 7 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(4-morpholinylmethyl)-4-nitro-?
The CAS number of 2H-Benzimidazole-2-thione, 1,3-dihydro-1,3-bis(4-morpholinylmethyl)-4-nitro- is 112094-10-7.
What is the molecular formula of 2H-Benzimidazole-2-thione, 1,3-dihydro-1,3-bis(4-morpholinylmethyl)-4-nitro-?
The molecular formula of 2H-Benzimidazole-2-thione, 1,3-dihydro-1,3-bis(4-morpholinylmethyl)-4-nitro- is C17H23N5O4S.
What is the molecular weight of 2H-Benzimidazole-2-thione, 1,3-dihydro-1,3-bis(4-morpholinylmethyl)-4-nitro-?
The molecular weight of 2H-Benzimidazole-2-thione, 1,3-dihydro-1,3-bis(4-morpholinylmethyl)-4-nitro- is 393.15 g/mol.
Where can I buy 2H-Benzimidazole-2-thione, 1,3-dihydro-1,3-bis(4-morpholinylmethyl)-4-nitro-?
You can request a quote for 2H-Benzimidazole-2-thione, 1,3-dihydro-1,3-bis(4-morpholinylmethyl)-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(4-morpholinylmethyl)-4-nitro-?
Yes, KEHONG BIO provides custom synthesis services for 2H-Benzimidazole-2-thione, 1,3-dihydro-1,3-bis(4-morpholinylmethyl)-4-nitro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.