Benzilato di 3-morfolinometil-2-bornanolo cloridrato
TL;DR: Benzilato di 3-morfolinometil-2-bornanolo cloridrato (CAS 17170-65-9) is a chemical compound with molecular formula C29H38ClNO4 and molecular weight 499.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[1,7,7-trimethyl-3-(morpholin-4-ylmethyl)-2-bicyclo[2.2.1]heptanyl] 2-hydroxy-2,2-diphenylacetate;hydrochloride
Also Known As: Benzilato di 3-morfolinometil-2-bornanolo cloridrato, Benzilato di 3-morfolinometil-2-bornanolo cloridrato [Italian], 2-Bornanol, 3-(morpholinomethyl)-, benzilate (ester), hydrochloride, Benzeneacetic acid, alpha-hydroxy-alpha-phenyl-, 3-(4-morpholinylmethyl)-1,7,7-trimethylbicyclo(2.2.1)hept-2-yl ester, hydrochloride, [4,7,7-trimethyl-2-(morpholin-4-ylmethyl)-3-bicyclo[2.2.1]heptanyl] 2-hydroxy-2,2-diphenylacetate hydrochloride
| Molecular Formula | C29H38ClNO4 |
|---|---|
| Molecular Weight | 499.25 g/mol |
| LogP | 4.6606 |
| Topological Polar Surface Area | 59.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 499.24893 |
| Heavy Atoms | 35 |
| Complexity | 702.0 |
Chemical Identifiers
| CAS Number | 17170-65-9 |
|---|---|
| SMILES | CC1(C2CCC1(C(C2CN3CCOCC3)OC(=O)C(C4=CC=CC=C4)(C5=CC=CC=C5)O)C)C.Cl |
| InChIKey | LBIJAVVDWILGGB-UHFFFAOYSA-N |
Product Overview
Benzilato di 3-morfolinometil-2-bornanolo cloridrato (CAS 17170-65-9), with molecular formula C29H38ClNO4 and molecular weight 499.25 g/mol. IUPAC: [1,7,7-trimethyl-3-(morpholin-4-ylmethyl)-2-bicyclo[2.2.1]heptanyl] 2-hydroxy-2,2-diphenylacetate;hydrochloride.
Chemical Property Profile of Benzilato di 3-morfolinometil-2-bornanolo cloridrato
Property Insights of Benzilato di 3-morfolinometil-2-bornanolo cloridrato
The XLogP value of 4.6606 indicates that Benzilato di 3-morfolinometil-2-bornanolo cloridrato is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.0 Ų, Benzilato di 3-morfolinometil-2-bornanolo cloridrato exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzilato di 3-morfolinometil-2-bornanolo cloridrato has 2 hydrogen bond donor(s) and 5 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 Benzilato di 3-morfolinometil-2-bornanolo cloridrato?
The CAS number of Benzilato di 3-morfolinometil-2-bornanolo cloridrato is 17170-65-9.
What is the molecular formula of Benzilato di 3-morfolinometil-2-bornanolo cloridrato?
The molecular formula of Benzilato di 3-morfolinometil-2-bornanolo cloridrato is C29H38ClNO4.
What is the molecular weight of Benzilato di 3-morfolinometil-2-bornanolo cloridrato?
The molecular weight of Benzilato di 3-morfolinometil-2-bornanolo cloridrato is 499.25 g/mol.
Where can I buy Benzilato di 3-morfolinometil-2-bornanolo cloridrato?
You can request a quote for Benzilato di 3-morfolinometil-2-bornanolo cloridrato directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzilato di 3-morfolinometil-2-bornanolo cloridrato?
Yes, KEHONG BIO provides custom synthesis services for Benzilato di 3-morfolinometil-2-bornanolo cloridrato and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.