4,5-dihydro-1H-imidazol-2-yl 3-phenylpropyl sulfide
TL;DR: 4,5-dihydro-1H-imidazol-2-yl 3-phenylpropyl sulfide (CAS 1001784-49-1) is a chemical compound with molecular formula C12H16N2S and molecular weight 220.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3-phenylpropylsulfanyl)-4,5-dihydro-1H-imidazole
Also Known As: 4,5-dihydro-1H-imidazol-2-yl 3-phenylpropyl sulfide, 2-(3-phenylpropylsulfanyl)-4,5-dihydro-1H-imidazole, AS-871/43476877
| Molecular Formula | C12H16N2S |
|---|---|
| Molecular Weight | 220.10 g/mol |
| LogP | 2.3116 |
| Topological Polar Surface Area | 24.39 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 220.10342 |
| Heavy Atoms | 15 |
| Complexity | 321.6538 |
Chemical Identifiers
| CAS Number | 1001784-49-1 |
|---|---|
| SMILES | C1CN=C(N1)SCCCC2=CC=CC=C2 |
Product Overview
4,5-dihydro-1H-imidazol-2-yl 3-phenylpropyl sulfide (CAS 1001784-49-1), with molecular formula C12H16N2S and molecular weight 220.10 g/mol. IUPAC: 2-(3-phenylpropylsulfanyl)-4,5-dihydro-1H-imidazole.
Chemical Property Profile of 4,5-dihydro-1H-imidazol-2-yl 3-phenylpropyl sulfide
Property Insights of 4,5-dihydro-1H-imidazol-2-yl 3-phenylpropyl sulfide
The XLogP value of 2.3116 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4,5-dihydro-1H-imidazol-2-yl 3-phenylpropyl sulfide. With a topological polar surface area (TPSA) of 24.39 Ų, 4,5-dihydro-1H-imidazol-2-yl 3-phenylpropyl sulfide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4,5-dihydro-1H-imidazol-2-yl 3-phenylpropyl sulfide has 1 hydrogen bond donor(s) and 3 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 4,5-dihydro-1H-imidazol-2-yl 3-phenylpropyl sulfide?
The CAS number of 4,5-dihydro-1H-imidazol-2-yl 3-phenylpropyl sulfide is 1001784-49-1.
What is the molecular formula of 4,5-dihydro-1H-imidazol-2-yl 3-phenylpropyl sulfide?
The molecular formula of 4,5-dihydro-1H-imidazol-2-yl 3-phenylpropyl sulfide is C12H16N2S.
What is the molecular weight of 4,5-dihydro-1H-imidazol-2-yl 3-phenylpropyl sulfide?
The molecular weight of 4,5-dihydro-1H-imidazol-2-yl 3-phenylpropyl sulfide is 220.10 g/mol.
Where can I buy 4,5-dihydro-1H-imidazol-2-yl 3-phenylpropyl sulfide?
You can request a quote for 4,5-dihydro-1H-imidazol-2-yl 3-phenylpropyl sulfide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,5-dihydro-1H-imidazol-2-yl 3-phenylpropyl sulfide?
Yes, KEHONG BIO provides custom synthesis services for 4,5-dihydro-1H-imidazol-2-yl 3-phenylpropyl sulfide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.