(2-(benzylthio)-4,5-dihydro-1H-imidazol-1-yl)(4-isopropoxyphenyl)methanone
TL;DR: (2-(benzylthio)-4,5-dihydro-1H-imidazol-1-yl)(4-isopropoxyphenyl)methanone (CAS 851863-80-4) is a chemical compound with molecular formula C20H22N2O2S and molecular weight 354.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-benzylsulfanyl-4,5-dihydroimidazol-1-yl)-(4-propan-2-yloxyphenyl)methanone
Also Known As: (2-(benzylthio)-4,5-dihydro-1H-imidazol-1-yl)(4-isopropoxyphenyl)methanone, 2-(benzylsulfanyl)-1-[4-(propan-2-yloxy)benzoyl]-4,5-dihydro-1H-imidazole, F0630-0204, (2-benzylsulfanyl-4,5-dihydroimidazol-1-yl)-(4-propan-2-yloxyphenyl)methanone
| Molecular Formula | C20H22N2O2S |
|---|---|
| Molecular Weight | 354.14 g/mol |
| LogP | 4.219 |
| Topological Polar Surface Area | 41.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 354.1402 |
| Heavy Atoms | 25 |
| Complexity | 742.0513 |
Chemical Identifiers
| CAS Number | 851863-80-4 |
|---|---|
| SMILES | CC(C)OC1=CC=C(C=C1)C(=O)N2CCN=C2SCC3=CC=CC=C3 |
Product Overview
(2-(benzylthio)-4,5-dihydro-1H-imidazol-1-yl)(4-isopropoxyphenyl)methanone (CAS 851863-80-4), with molecular formula C20H22N2O2S and molecular weight 354.14 g/mol. IUPAC: (2-benzylsulfanyl-4,5-dihydroimidazol-1-yl)-(4-propan-2-yloxyphenyl)methanone.
Chemical Property Profile of (2-(benzylthio)-4,5-dihydro-1H-imidazol-1-yl)(4-isopropoxyphenyl)methanone
Property Insights of (2-(benzylthio)-4,5-dihydro-1H-imidazol-1-yl)(4-isopropoxyphenyl)methanone
The XLogP value of 4.219 indicates that (2-(benzylthio)-4,5-dihydro-1H-imidazol-1-yl)(4-isopropoxyphenyl)methanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.9 Ų, (2-(benzylthio)-4,5-dihydro-1H-imidazol-1-yl)(4-isopropoxyphenyl)methanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (2-(benzylthio)-4,5-dihydro-1H-imidazol-1-yl)(4-isopropoxyphenyl)methanone has 0 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-(benzylthio)-4,5-dihydro-1H-imidazol-1-yl)(4-isopropoxyphenyl)methanone?
The CAS number of (2-(benzylthio)-4,5-dihydro-1H-imidazol-1-yl)(4-isopropoxyphenyl)methanone is 851863-80-4.
What is the molecular formula of (2-(benzylthio)-4,5-dihydro-1H-imidazol-1-yl)(4-isopropoxyphenyl)methanone?
The molecular formula of (2-(benzylthio)-4,5-dihydro-1H-imidazol-1-yl)(4-isopropoxyphenyl)methanone is C20H22N2O2S.
What is the molecular weight of (2-(benzylthio)-4,5-dihydro-1H-imidazol-1-yl)(4-isopropoxyphenyl)methanone?
The molecular weight of (2-(benzylthio)-4,5-dihydro-1H-imidazol-1-yl)(4-isopropoxyphenyl)methanone is 354.14 g/mol.
Where can I buy (2-(benzylthio)-4,5-dihydro-1H-imidazol-1-yl)(4-isopropoxyphenyl)methanone?
You can request a quote for (2-(benzylthio)-4,5-dihydro-1H-imidazol-1-yl)(4-isopropoxyphenyl)methanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2-(benzylthio)-4,5-dihydro-1H-imidazol-1-yl)(4-isopropoxyphenyl)methanone?
Yes, KEHONG BIO provides custom synthesis services for (2-(benzylthio)-4,5-dihydro-1H-imidazol-1-yl)(4-isopropoxyphenyl)methanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.