RefChem:324287
TL;DR: RefChem:324287 (CAS 17066-38-5) is a chemical compound with molecular formula C30H40N2O3 and molecular weight 476.30 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[1,7,7-trimethyl-3-[(4-methylpiperazin-1-yl)methyl]-2-bicyclo[2.2.1]heptanyl] 2-hydroxy-2,2-diphenylacetate
Also Known As: Benzilato di 3-(N'-metilpiperazino)metil-2-bornanolo, Benzilato di 3-(N'-metilpiperazino)metil-2-bornanolo [Italian], 2-Bornanol, 3-((4-methyl-1-piperazinyl)methyl)-, benzilate (ester), Benzeneacetic acid, alpha-hydroxy-alpha-phenyl-, 3-(4-methyl-1-piperazinyl)-1,7,7-trimethylbicyclo(2.2.1)hept-2-yl ester, [4,7,7-trimethyl-2-[(4-methylpiperazin-1-yl)methyl]-3-bicyclo[2.2.1]heptanyl] 2-hydroxy-2,2-diphenylacetate
| Molecular Formula | C30H40N2O3 |
|---|---|
| Molecular Weight | 476.30 g/mol |
| LogP | 5.4 |
| Topological Polar Surface Area | 53.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 476.3039 |
| Heavy Atoms | 35 |
| Complexity | 731.0 |
Chemical Identifiers
| CAS Number | 17066-38-5 |
|---|---|
| SMILES | CC1(C2CCC1(C(C2CN3CCN(CC3)C)OC(=O)C(C4=CC=CC=C4)(C5=CC=CC=C5)O)C)C |
| InChIKey | ZUWBTHWPNHBWAU-UHFFFAOYSA-N |
Product Overview
RefChem:324287 (CAS 17066-38-5), with molecular formula C30H40N2O3 and molecular weight 476.30 g/mol. IUPAC: [1,7,7-trimethyl-3-[(4-methylpiperazin-1-yl)methyl]-2-bicyclo[2.2.1]heptanyl] 2-hydroxy-2,2-diphenylacetate.
Chemical Property Profile of RefChem:324287
Property Insights of RefChem:324287
The XLogP value of 5.4 indicates that RefChem:324287 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 53.0 Ų, RefChem:324287 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:324287 has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:324287?
The CAS number of RefChem:324287 is 17066-38-5.
What is the molecular formula of RefChem:324287?
The molecular formula of RefChem:324287 is C30H40N2O3.
What is the molecular weight of RefChem:324287?
The molecular weight of RefChem:324287 is 476.30 g/mol.
Where can I buy RefChem:324287?
You can request a quote for RefChem:324287 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:324287?
Yes, KEHONG BIO provides custom synthesis services for RefChem:324287 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.