RefChem:217652
TL;DR: RefChem:217652 (CAS 102395-56-2) is a chemical compound with molecular formula C25H31N3O2 and molecular weight 405.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-[3-(2,3-dihydro-1-benzofuran-2-yl)propyl]-3-methyl-1-phenyl-1,3,8-triazaspiro[4.5]decan-4-one
Also Known As: 8-(3-(2,3-Dihydro-2-benzofuranyl)propyl)-3-methyl-4-oxo-1-phenyl-1,3,8-triazaspiro(4.5)decane, 1,3,8-Triazaspiro(4.5)decan-4-one, 8-(3-(2,3-dihydrobenzofuran-2-yl)propyl)-3-methyl-1-phenyl-, 8-[3-(2,3-dihydro-1-benzofuran-2-yl)propyl]-3-methyl-1-phenyl-1,3,8-triazaspiro[4.5]decan-4-one, 8-[3-(2,3-dihydro-1-benzofuran-2-yl)propyl]-2-methyl-4-phenyl-2,4,8-triazaspiro[4.5]decan-1-one, 8-[3-(2,3-dihydrobenzofuran-2-yl)propyl]-2-methyl-4-phenyl-2,4,8-triazaspiro[4.5]decan-1-one
| Molecular Formula | C25H31N3O2 |
|---|---|
| Molecular Weight | 405.24 g/mol |
| LogP | 4.3 |
| Topological Polar Surface Area | 36.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 405.24164 |
| Heavy Atoms | 30 |
| Complexity | 597.0 |
Chemical Identifiers
| CAS Number | 102395-56-2 |
|---|---|
| SMILES | CN1CN(C2(C1=O)CCN(CC2)CCCC3CC4=CC=CC=C4O3)C5=CC=CC=C5 |
| InChIKey | MFIMWTJHRRPOPK-UHFFFAOYSA-N |
Product Overview
RefChem:217652 (CAS 102395-56-2), with molecular formula C25H31N3O2 and molecular weight 405.24 g/mol. IUPAC: 8-[3-(2,3-dihydro-1-benzofuran-2-yl)propyl]-3-methyl-1-phenyl-1,3,8-triazaspiro[4.5]decan-4-one.
Chemical Property Profile of RefChem:217652
Property Insights of RefChem:217652
The XLogP value of 4.3 indicates that RefChem:217652 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 36.0 Ų, RefChem:217652 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:217652 has 0 hydrogen bond donor(s) and 4 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:217652?
The CAS number of RefChem:217652 is 102395-56-2.
What is the molecular formula of RefChem:217652?
The molecular formula of RefChem:217652 is C25H31N3O2.
What is the molecular weight of RefChem:217652?
The molecular weight of RefChem:217652 is 405.24 g/mol.
Where can I buy RefChem:217652?
You can request a quote for RefChem:217652 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:217652?
Yes, KEHONG BIO provides custom synthesis services for RefChem:217652 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.