![N-[[4-(1H-benzimidazol-2-yl)phenyl]carbamothioyl]-2-morpholin-4-yl-5-nitrobenzamide structure](/static/products/833/833436-90-1.png)
N-[[4-(1H-benzimidazol-2-yl)phenyl]carbamothioyl]-2-morpholin-4-yl-5-nitrobenzamide
TL;DR: N-[[4-(1H-benzimidazol-2-yl)phenyl]carbamothioyl]-2-morpholin-4-yl-5-nitrobenzamide (CAS 833436-90-1) is a chemical compound with molecular formula C25H22N6O4S and molecular weight 502.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[4-(1H-benzimidazol-2-yl)phenyl]carbamothioyl]-2-morpholin-4-yl-5-nitrobenzamide
Also Known As: N-[[4-(1H-benzimidazol-2-yl)phenyl]carbamothioyl]-2-morpholin-4-yl-5-nitrobenzamide, N-[[4-(1H-benzoimidazol-2-yl)phenyl]thiocarbamoyl]-2-morpholin-4-yl-5-nitro-benzamide, N-{[4-(1H-benzimidazol-2-yl)phenyl]carbamothioyl}-2-(morpholin-4-yl)-5-nitrobenzamide
| Molecular Formula | C25H22N6O4S |
|---|---|
| Molecular Weight | 502.14 g/mol |
| LogP | 4.1015 |
| Topological Polar Surface Area | 125.42 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 502.14233 |
| Heavy Atoms | 36 |
| Complexity | 1413.724 |
Chemical Identifiers
| CAS Number | 833436-90-1 |
|---|---|
| SMILES | C1COCCN1C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)NC(=S)NC3=CC=C(C=C3)C4=NC5=CC=CC=C5N4 |
Product Overview
N-[[4-(1H-benzimidazol-2-yl)phenyl]carbamothioyl]-2-morpholin-4-yl-5-nitrobenzamide (CAS 833436-90-1), with molecular formula C25H22N6O4S and molecular weight 502.14 g/mol. IUPAC: N-[[4-(1H-benzimidazol-2-yl)phenyl]carbamothioyl]-2-morpholin-4-yl-5-nitrobenzamide.
Chemical Property Profile of N-[[4-(1H-benzimidazol-2-yl)phenyl]carbamothioyl]-2-morpholin-4-yl-5-nitrobenzamide
Property Insights of N-[[4-(1H-benzimidazol-2-yl)phenyl]carbamothioyl]-2-morpholin-4-yl-5-nitrobenzamide
The XLogP value of 4.1015 indicates that N-[[4-(1H-benzimidazol-2-yl)phenyl]carbamothioyl]-2-morpholin-4-yl-5-nitrobenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 125.42 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[[4-(1H-benzimidazol-2-yl)phenyl]carbamothioyl]-2-morpholin-4-yl-5-nitrobenzamide. Following Lipinski's Rule of Five, N-[[4-(1H-benzimidazol-2-yl)phenyl]carbamothioyl]-2-morpholin-4-yl-5-nitrobenzamide has 3 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-[[4-(1H-benzimidazol-2-yl)phenyl]carbamothioyl]-2-morpholin-4-yl-5-nitrobenzamide?
The CAS number of N-[[4-(1H-benzimidazol-2-yl)phenyl]carbamothioyl]-2-morpholin-4-yl-5-nitrobenzamide is 833436-90-1.
What is the molecular formula of N-[[4-(1H-benzimidazol-2-yl)phenyl]carbamothioyl]-2-morpholin-4-yl-5-nitrobenzamide?
The molecular formula of N-[[4-(1H-benzimidazol-2-yl)phenyl]carbamothioyl]-2-morpholin-4-yl-5-nitrobenzamide is C25H22N6O4S.
What is the molecular weight of N-[[4-(1H-benzimidazol-2-yl)phenyl]carbamothioyl]-2-morpholin-4-yl-5-nitrobenzamide?
The molecular weight of N-[[4-(1H-benzimidazol-2-yl)phenyl]carbamothioyl]-2-morpholin-4-yl-5-nitrobenzamide is 502.14 g/mol.
Where can I buy N-[[4-(1H-benzimidazol-2-yl)phenyl]carbamothioyl]-2-morpholin-4-yl-5-nitrobenzamide?
You can request a quote for N-[[4-(1H-benzimidazol-2-yl)phenyl]carbamothioyl]-2-morpholin-4-yl-5-nitrobenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[[4-(1H-benzimidazol-2-yl)phenyl]carbamothioyl]-2-morpholin-4-yl-5-nitrobenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-[[4-(1H-benzimidazol-2-yl)phenyl]carbamothioyl]-2-morpholin-4-yl-5-nitrobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.