Ici 197067
TL;DR: Ici 197067 (CAS 115199-69-4) is a chemical compound with molecular formula C18H27Cl3N2O and molecular weight 392.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3,4-dichlorophenyl)-N-methyl-N-[(2S)-3-methyl-1-pyrrolidin-1-ylbutan-2-yl]acetamide;hydrochloride
Also Known As: Ici 197067, Ici 197,607, N-(2 (N-Methyl-3,4-dichlorophenylacetamido)-3-methylbutyl)pyrrolidine, 2-(3,4-dichlorophenyl)-N-methyl-N-[(2S)-3-methyl-1-pyrrolidin-1-ylbutan-2-yl]acetamide;hydrochloride, Benzeneacetamide, 3,4-dichloro-N-methyl-N-(2-methyl-1-(1-pyrrolidinylmethyl)propyl)-, monohydrochloride, (S)-
| Molecular Formula | C18H27Cl3N2O |
|---|---|
| Molecular Weight | 392.12 g/mol |
| LogP | 4.5365 |
| Topological Polar Surface Area | 23.55 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 392.1189 |
| Heavy Atoms | 24 |
| Complexity | 545.0654 |
Chemical Identifiers
| CAS Number | 115199-69-4 |
|---|---|
| SMILES | CC(C)[C@@H](CN1CCCC1)N(C)C(=O)CC2=CC(=C(C=C2)Cl)Cl.Cl |
Product Overview
Ici 197067 (CAS 115199-69-4), with molecular formula C18H27Cl3N2O and molecular weight 392.12 g/mol. IUPAC: 2-(3,4-dichlorophenyl)-N-methyl-N-[(2S)-3-methyl-1-pyrrolidin-1-ylbutan-2-yl]acetamide;hydrochloride.
Chemical Property Profile of Ici 197067
Property Insights of Ici 197067
The XLogP value of 4.5365 indicates that Ici 197067 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 23.55 Ų, Ici 197067 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ici 197067 has 0 hydrogen bond donor(s) and 2 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 Ici 197067?
The CAS number of Ici 197067 is 115199-69-4.
What is the molecular formula of Ici 197067?
The molecular formula of Ici 197067 is C18H27Cl3N2O.
What is the molecular weight of Ici 197067?
The molecular weight of Ici 197067 is 392.12 g/mol.
Where can I buy Ici 197067?
You can request a quote for Ici 197067 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ici 197067?
Yes, KEHONG BIO provides custom synthesis services for Ici 197067 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.