2-(1H-benzimidazol-2-ylsulfanyl)-1-(morpholin-4-yl)ethanone
TL;DR: 2-(1H-benzimidazol-2-ylsulfanyl)-1-(morpholin-4-yl)ethanone (CAS 30065-31-7) is a chemical compound with molecular formula C13H15N3O2S and molecular weight 277.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1H-benzimidazol-2-ylsulfanyl)-1-morpholin-4-ylethanone
Also Known As: 2-(1H-benzimidazol-2-ylsulfanyl)-1-(morpholin-4-yl)ethanone, 2-(1H-benzimidazol-2-ylsulfanyl)-1-morpholin-4-ylethanone, 2-benzimidazol-2-ylthio-1-morpholin-4-ylethan-1-one, 2-(1H-1,3-benzodiazol-2-ylsulfanyl)-1-(morpholin-4-yl)ethan-1-one
| Molecular Formula | C13H15N3O2S |
|---|---|
| Molecular Weight | 277.09 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 83.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 277.0885 |
| Heavy Atoms | 19 |
| Complexity | 323.0 |
Chemical Identifiers
| CAS Number | 30065-31-7 |
|---|---|
| SMILES | C1COCCN1C(=O)CSC2=NC3=CC=CC=C3N2 |
| InChIKey | KBIRGWLDHMLJDW-UHFFFAOYSA-N |
Product Overview
2-(1H-benzimidazol-2-ylsulfanyl)-1-(morpholin-4-yl)ethanone (CAS 30065-31-7), with molecular formula C13H15N3O2S and molecular weight 277.09 g/mol. IUPAC: 2-(1H-benzimidazol-2-ylsulfanyl)-1-morpholin-4-ylethanone.
Chemical Property Profile of 2-(1H-benzimidazol-2-ylsulfanyl)-1-(morpholin-4-yl)ethanone
Property Insights of 2-(1H-benzimidazol-2-ylsulfanyl)-1-(morpholin-4-yl)ethanone
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(1H-benzimidazol-2-ylsulfanyl)-1-(morpholin-4-yl)ethanone. The TPSA of 83.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(1H-benzimidazol-2-ylsulfanyl)-1-(morpholin-4-yl)ethanone. Following Lipinski's Rule of Five, 2-(1H-benzimidazol-2-ylsulfanyl)-1-(morpholin-4-yl)ethanone has 1 hydrogen bond donor(s) and 4 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 2-(1H-benzimidazol-2-ylsulfanyl)-1-(morpholin-4-yl)ethanone?
The CAS number of 2-(1H-benzimidazol-2-ylsulfanyl)-1-(morpholin-4-yl)ethanone is 30065-31-7.
What is the molecular formula of 2-(1H-benzimidazol-2-ylsulfanyl)-1-(morpholin-4-yl)ethanone?
The molecular formula of 2-(1H-benzimidazol-2-ylsulfanyl)-1-(morpholin-4-yl)ethanone is C13H15N3O2S.
What is the molecular weight of 2-(1H-benzimidazol-2-ylsulfanyl)-1-(morpholin-4-yl)ethanone?
The molecular weight of 2-(1H-benzimidazol-2-ylsulfanyl)-1-(morpholin-4-yl)ethanone is 277.09 g/mol.
Where can I buy 2-(1H-benzimidazol-2-ylsulfanyl)-1-(morpholin-4-yl)ethanone?
You can request a quote for 2-(1H-benzimidazol-2-ylsulfanyl)-1-(morpholin-4-yl)ethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(1H-benzimidazol-2-ylsulfanyl)-1-(morpholin-4-yl)ethanone?
Yes, KEHONG BIO provides custom synthesis services for 2-(1H-benzimidazol-2-ylsulfanyl)-1-(morpholin-4-yl)ethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.