Ssr 146977
TL;DR: Ssr 146977 (CAS 264618-44-2) is a chemical compound with molecular formula C35H42Cl2N4O2 and molecular weight 620.27 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[1-[3-[(3R)-1-benzoyl-3-(3,4-dichlorophenyl)piperidin-3-yl]propyl]-4-phenylpiperidin-4-yl]-1,1-dimethylurea
Also Known As: SSR 146977 hydrochloride, Tox21_300229, CAS-264618-44-2, 3-[1-[3-[(3R)-1-(benzoyl)-3-(3,4-dichlorophenyl)piperidin-3-yl]propyl]-4-phenylpiperidin-4-yl]-1,1-dimethylurea, 3-[1-[3-[(3R)-1-benzoyl-3-(3,4-dichlorophenyl)piperidin-3-yl]propyl]-4-phenylpiperidin-4-yl]-1,1-dimethylurea
| Molecular Formula | C35H42Cl2N4O2 |
|---|---|
| Molecular Weight | 620.27 g/mol |
| LogP | 7.2101 |
| Topological Polar Surface Area | 55.89 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 8 |
| Exact Mass | 620.2685 |
| Heavy Atoms | 43 |
| Complexity | 1393.4664 |
Chemical Identifiers
| CAS Number | 264618-44-2 |
|---|---|
| SMILES | CN(C)C(=O)NC1(CCN(CC1)CCC[C@@]2(CCCN(C2)C(=O)C3=CC=CC=C3)C4=CC(=C(C=C4)Cl)Cl)C5=CC=CC=C5 |
Product Overview
Ssr 146977 (CAS 264618-44-2), with molecular formula C35H42Cl2N4O2 and molecular weight 620.27 g/mol. IUPAC: 3-[1-[3-[(3R)-1-benzoyl-3-(3,4-dichlorophenyl)piperidin-3-yl]propyl]-4-phenylpiperidin-4-yl]-1,1-dimethylurea.
Chemical Property Profile of Ssr 146977
Property Insights of Ssr 146977
The XLogP value of 7.2101 indicates that Ssr 146977 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.89 Ų, Ssr 146977 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ssr 146977 has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Ssr 146977?
The CAS number of Ssr 146977 is 264618-44-2.
What is the molecular formula of Ssr 146977?
The molecular formula of Ssr 146977 is C35H42Cl2N4O2.
What is the molecular weight of Ssr 146977?
The molecular weight of Ssr 146977 is 620.27 g/mol.
Where can I buy Ssr 146977?
You can request a quote for Ssr 146977 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ssr 146977?
Yes, KEHONG BIO provides custom synthesis services for Ssr 146977 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.