J1.647.948I
TL;DR: J1.647.948I (CAS 178981-89-0) is a chemical compound with molecular formula C19H19Cl2N3OS and molecular weight 407.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[5-(3,5-dichlorophenyl)sulfanyl-4-propan-2-yl-1-(pyridin-4-ylmethyl)imidazol-2-yl]methanol
Also Known As: J1.647.948I, {5-[(3,5-DICHLOROPHENYL)SULFANYL]-4-ISOPROPYL-1-((PYRIDIN-4-YL)METHYL)IMIDAZOL-2-YL}METHANOL, [5-(3,5-dichlorophenyl)sulfanyl-4-propan-2-yl-1-(pyridin-4-ylmethyl)imidazol-2-yl]methanol, {5-[(3,5-Dichlorophenyl)sulfanyl]-4-(propan-2-yl)-1-[(pyridin-4-yl)methyl]-1H-imidazol-2-yl}methanol, {5-[(3,5-DICHLOROPHENYL)SULFANYL]-4-ISOPROPYL-1-(PYRIDIN-4-YLMETHYL)IMIDAZOL-2-YL}METHANOL
| Molecular Formula | C19H19Cl2N3OS |
|---|---|
| Molecular Weight | 407.06 g/mol |
| LogP | 5.4001 |
| Topological Polar Surface Area | 50.94 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 407.0626 |
| Heavy Atoms | 26 |
| Complexity | 877.0499 |
Chemical Identifiers
| CAS Number | 178981-89-0 |
|---|---|
| SMILES | CC(C)C1=C(N(C(=N1)CO)CC2=CC=NC=C2)SC3=CC(=CC(=C3)Cl)Cl |
Product Overview
J1.647.948I (CAS 178981-89-0), with molecular formula C19H19Cl2N3OS and molecular weight 407.06 g/mol. IUPAC: [5-(3,5-dichlorophenyl)sulfanyl-4-propan-2-yl-1-(pyridin-4-ylmethyl)imidazol-2-yl]methanol.
Chemical Property Profile of J1.647.948I
Property Insights of J1.647.948I
The XLogP value of 5.4001 indicates that J1.647.948I is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.94 Ų, J1.647.948I exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, J1.647.948I has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of J1.647.948I?
The CAS number of J1.647.948I is 178981-89-0.
What is the molecular formula of J1.647.948I?
The molecular formula of J1.647.948I is C19H19Cl2N3OS.
What is the molecular weight of J1.647.948I?
The molecular weight of J1.647.948I is 407.06 g/mol.
Where can I buy J1.647.948I?
You can request a quote for J1.647.948I directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for J1.647.948I?
Yes, KEHONG BIO provides custom synthesis services for J1.647.948I and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.