RefChem:1071464
TL;DR: RefChem:1071464 (CAS 36174-43-3) is a chemical compound with molecular formula C30H42Cl2N2O2 and molecular weight 532.26 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[5-(azepan-1-ylmethyl)-1,2,5-trimethyl-4-phenylpiperidin-4-yl] (E)-3-phenylprop-2-enoate;dihydrochloride
Also Known As: 4-Piperidinol, 5-(hexahydro-1H-azepinylmethyl)-4-phenyl-1,2,5-trimethyl-, cinnamate, dihydrochloride, [5-(azepan-1-ylmethyl)-1,2,5-trimethyl-4-phenylpiperidin-4-yl] (E)-3-phenylprop-2-enoate dihydrochloride, 2-Propenoic acid, 3-phenyl-, 5-[(hexahydro-1H-azepin-1-yl)methyl]-1,2,5-trimethyl-4-phenyl-4-piperidinyl ester, dihydrochloride, RefChem:1071464
| Molecular Formula | C30H42Cl2N2O2 |
|---|---|
| Molecular Weight | 532.26 g/mol |
| LogP | 6.5884 |
| Topological Polar Surface Area | 32.78 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 532.2623 |
| Heavy Atoms | 36 |
| Complexity | 963.4289 |
Chemical Identifiers
| CAS Number | 36174-43-3 |
|---|---|
| SMILES | CC1CC(C(CN1C)(C)CN2CCCCCC2)(C3=CC=CC=C3)OC(=O)/C=C/C4=CC=CC=C4.Cl.Cl |
Product Overview
RefChem:1071464 (CAS 36174-43-3), with molecular formula C30H42Cl2N2O2 and molecular weight 532.26 g/mol. IUPAC: [5-(azepan-1-ylmethyl)-1,2,5-trimethyl-4-phenylpiperidin-4-yl] (E)-3-phenylprop-2-enoate;dihydrochloride.
Chemical Property Profile of RefChem:1071464
Property Insights of RefChem:1071464
The XLogP value of 6.5884 indicates that RefChem:1071464 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 32.78 Ų, RefChem:1071464 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:1071464 has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:1071464?
The CAS number of RefChem:1071464 is 36174-43-3.
What is the molecular formula of RefChem:1071464?
The molecular formula of RefChem:1071464 is C30H42Cl2N2O2.
What is the molecular weight of RefChem:1071464?
The molecular weight of RefChem:1071464 is 532.26 g/mol.
Where can I buy RefChem:1071464?
You can request a quote for RefChem:1071464 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1071464?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1071464 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.