RefChem:329204
TL;DR: RefChem:329204 (CAS 13083-70-0) is a chemical compound with molecular formula C27H35NO2 and molecular weight 405.27 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[3-[(dimethylamino)methyl]-1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl] 2,2-diphenylacetate
Also Known As: Difenilacetato di 3-dimetilaminometil-2-bornanolo, Difenilacetato di 3-dimetilaminometil-2-bornanolo [Italian], 2-Bornanol, 3-((dimethylamino)methyl)-, diphenylacetate (ester), Bicyclo(2.2.1)heptan-2-ol, 3-((dimethylamino)methyl)-1,7,7-triphenyl-, alpha-phenylbenzeneacetate (ester), [2-(dimethylaminomethyl)-4,7,7-trimethyl-3-bicyclo[2.2.1]heptanyl] 2,2-diphenylacetate
| Molecular Formula | C27H35NO2 |
|---|---|
| Molecular Weight | 405.27 g/mol |
| LogP | 6.3 |
| Topological Polar Surface Area | 29.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 405.26678 |
| Heavy Atoms | 30 |
| Complexity | 584.0 |
Chemical Identifiers
| CAS Number | 13083-70-0 |
|---|---|
| SMILES | CC1(C2CCC1(C(C2CN(C)C)OC(=O)C(C3=CC=CC=C3)C4=CC=CC=C4)C)C |
| InChIKey | NGSDCQQOMVUTRX-UHFFFAOYSA-N |
Product Overview
RefChem:329204 (CAS 13083-70-0), with molecular formula C27H35NO2 and molecular weight 405.27 g/mol. IUPAC: [3-[(dimethylamino)methyl]-1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl] 2,2-diphenylacetate.
Chemical Property Profile of RefChem:329204
Property Insights of RefChem:329204
The XLogP value of 6.3 indicates that RefChem:329204 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.5 Ų, RefChem:329204 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:329204 has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:329204?
The CAS number of RefChem:329204 is 13083-70-0.
What is the molecular formula of RefChem:329204?
The molecular formula of RefChem:329204 is C27H35NO2.
What is the molecular weight of RefChem:329204?
The molecular weight of RefChem:329204 is 405.27 g/mol.
Where can I buy RefChem:329204?
You can request a quote for RefChem:329204 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:329204?
Yes, KEHONG BIO provides custom synthesis services for RefChem:329204 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.