![4-[3-(1H-benzimidazol-2-ylsulfanyl)-4-nitrophenyl]morpholine structure](/static/products/3309/330997-65-4.webp)
4-[3-(1H-benzimidazol-2-ylsulfanyl)-4-nitrophenyl]morpholine
TL;DR: 4-[3-(1H-benzimidazol-2-ylsulfanyl)-4-nitrophenyl]morpholine (CAS 330997-65-4) is a chemical compound with molecular formula C17H16N4O3S and molecular weight 356.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[3-(1H-benzimidazol-2-ylsulfanyl)-4-nitrophenyl]morpholine
Also Known As: ChemDiv1_001097, BAS 00327051, 4-[3-(1H-benzimidazol-2-ylsulfanyl)-4-nitrophenyl]morpholine, 2-(5-Morpholin-4-yl-2-nitro-phenylsulfanyl)-1H-benzoimidazole, 2-{[5-(morpholin-4-yl)-2-nitrophenyl]sulfanyl}-1H-benzimidazole
| Molecular Formula | C17H16N4O3S |
|---|---|
| Molecular Weight | 356.09 g/mol |
| LogP | 3.4589 |
| Topological Polar Surface Area | 84.29 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 356.0943 |
| Heavy Atoms | 25 |
| Complexity | 888.1519 |
Chemical Identifiers
| CAS Number | 330997-65-4 |
|---|---|
| SMILES | C1COCCN1C2=CC(=C(C=C2)[N+](=O)[O-])SC3=NC4=CC=CC=C4N3 |
Product Overview
4-[3-(1H-benzimidazol-2-ylsulfanyl)-4-nitrophenyl]morpholine (CAS 330997-65-4), with molecular formula C17H16N4O3S and molecular weight 356.09 g/mol. IUPAC: 4-[3-(1H-benzimidazol-2-ylsulfanyl)-4-nitrophenyl]morpholine.
Chemical Property Profile of 4-[3-(1H-benzimidazol-2-ylsulfanyl)-4-nitrophenyl]morpholine
Property Insights of 4-[3-(1H-benzimidazol-2-ylsulfanyl)-4-nitrophenyl]morpholine
The XLogP value of 3.4589 indicates that 4-[3-(1H-benzimidazol-2-ylsulfanyl)-4-nitrophenyl]morpholine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 84.29 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-[3-(1H-benzimidazol-2-ylsulfanyl)-4-nitrophenyl]morpholine. Following Lipinski's Rule of Five, 4-[3-(1H-benzimidazol-2-ylsulfanyl)-4-nitrophenyl]morpholine 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 4-[3-(1H-benzimidazol-2-ylsulfanyl)-4-nitrophenyl]morpholine?
The CAS number of 4-[3-(1H-benzimidazol-2-ylsulfanyl)-4-nitrophenyl]morpholine is 330997-65-4.
What is the molecular formula of 4-[3-(1H-benzimidazol-2-ylsulfanyl)-4-nitrophenyl]morpholine?
The molecular formula of 4-[3-(1H-benzimidazol-2-ylsulfanyl)-4-nitrophenyl]morpholine is C17H16N4O3S.
What is the molecular weight of 4-[3-(1H-benzimidazol-2-ylsulfanyl)-4-nitrophenyl]morpholine?
The molecular weight of 4-[3-(1H-benzimidazol-2-ylsulfanyl)-4-nitrophenyl]morpholine is 356.09 g/mol.
Where can I buy 4-[3-(1H-benzimidazol-2-ylsulfanyl)-4-nitrophenyl]morpholine?
You can request a quote for 4-[3-(1H-benzimidazol-2-ylsulfanyl)-4-nitrophenyl]morpholine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[3-(1H-benzimidazol-2-ylsulfanyl)-4-nitrophenyl]morpholine?
Yes, KEHONG BIO provides custom synthesis services for 4-[3-(1H-benzimidazol-2-ylsulfanyl)-4-nitrophenyl]morpholine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.