RefChem:240168
TL;DR: RefChem:240168 (CAS 142944-43-2) is a chemical compound with molecular formula C25H29ClN4O and molecular weight 436.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[3-[4-(3-chlorophenyl)piperazin-1-yl]propyl]-9-methyl-3,4-dihydropyrido[3,4-b]indol-1-one
Also Known As: p-tolylcarbamimidoyl-thiourea, NCI60_011162, 1H-Pyrido(3,4-b)indol-1-one, 2,3,4,9-tetrahydro-2-(3-(4-(3-chlorophenyl)-1-piperazinyl)propyl)-9-methyl-, 2-[3-[4-(3-chlorophenyl)piperazin-1-yl]propyl]-9-methyl-3,4-dihydropyrido[3,4-b]indol-1-one, 1H-Pyrido[3,4-b]indol-1-one, 2-[3-[4-(3-chlorophenyl)-1-piperazinyl]propyl]-2,3,4,9-tetrahydro-9-methyl-
| Molecular Formula | C25H29ClN4O |
|---|---|
| Molecular Weight | 436.20 g/mol |
| LogP | 4.4 |
| Topological Polar Surface Area | 31.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 436.203 |
| Heavy Atoms | 31 |
| Complexity | 625.0 |
Chemical Identifiers
| CAS Number | 142944-43-2 |
|---|---|
| SMILES | CN1C2=CC=CC=C2C3=C1C(=O)N(CC3)CCCN4CCN(CC4)C5=CC(=CC=C5)Cl |
| InChIKey | ZRYZUZQDKWTLMK-UHFFFAOYSA-N |
Product Overview
RefChem:240168 (CAS 142944-43-2), with molecular formula C25H29ClN4O and molecular weight 436.20 g/mol. IUPAC: 2-[3-[4-(3-chlorophenyl)piperazin-1-yl]propyl]-9-methyl-3,4-dihydropyrido[3,4-b]indol-1-one.
Chemical Property Profile of RefChem:240168
Property Insights of RefChem:240168
The XLogP value of 4.4 indicates that RefChem:240168 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 31.7 Ų, RefChem:240168 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:240168 has 0 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 RefChem:240168?
The CAS number of RefChem:240168 is 142944-43-2.
What is the molecular formula of RefChem:240168?
The molecular formula of RefChem:240168 is C25H29ClN4O.
What is the molecular weight of RefChem:240168?
The molecular weight of RefChem:240168 is 436.20 g/mol.
Where can I buy RefChem:240168?
You can request a quote for RefChem:240168 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:240168?
Yes, KEHONG BIO provides custom synthesis services for RefChem:240168 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.