KSD 2652
TL;DR: KSD 2652 (CAS 6606-13-9) is a chemical compound with molecular formula C30H33NO3 and molecular weight 455.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[9-[(2-methylphenyl)methyl]-9-azabicyclo[3.3.1]nonan-3-yl] 2-hydroxy-2,2-diphenylacetate
Also Known As: Diphenylhydroxyacetic acid 9-((2-methylphenyl)methyl)-9-azabicyclo(3.3.1)non-3-beta-yl ester, Acetic acid, diphenylhydroxy-, 9-((2-methylphenyl)methyl)-9-azabicyclo(3.3.1)non-3-beta-yl ester, [9-[(2-methylphenyl)methyl]-9-azabicyclo[3.3.1]nonan-3-yl] 2-hydroxy-2,2-diphenylacetate, 9-[(2-Methylphenyl)methyl]-9-azabicyclo[3.3.1]nonan-3-yl hydroxy(diphenyl)acetate, 9-[(2-Methylphenyl)methyl]-9-azabicyclo[3.3.1]nonan-3-yl hydroxydi(phenyl)acetate
| Molecular Formula | C30H33NO3 |
|---|---|
| Molecular Weight | 455.25 g/mol |
| LogP | 6.1 |
| Topological Polar Surface Area | 49.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 455.24603 |
| Heavy Atoms | 34 |
| Complexity | 636.0 |
Chemical Identifiers
| CAS Number | 6606-13-9 |
|---|---|
| SMILES | CC1=CC=CC=C1CN2C3CCCC2CC(C3)OC(=O)C(C4=CC=CC=C4)(C5=CC=CC=C5)O |
| InChIKey | ZXBJLDGKXWSTFQ-UHFFFAOYSA-N |
Product Overview
KSD 2652 (CAS 6606-13-9), with molecular formula C30H33NO3 and molecular weight 455.25 g/mol. IUPAC: [9-[(2-methylphenyl)methyl]-9-azabicyclo[3.3.1]nonan-3-yl] 2-hydroxy-2,2-diphenylacetate.
Chemical Property Profile of KSD 2652
Property Insights of KSD 2652
The XLogP value of 6.1 indicates that KSD 2652 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.8 Ų, KSD 2652 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, KSD 2652 has 1 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 KSD 2652?
The CAS number of KSD 2652 is 6606-13-9.
What is the molecular formula of KSD 2652?
The molecular formula of KSD 2652 is C30H33NO3.
What is the molecular weight of KSD 2652?
The molecular weight of KSD 2652 is 455.25 g/mol.
Where can I buy KSD 2652?
You can request a quote for KSD 2652 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for KSD 2652?
Yes, KEHONG BIO provides custom synthesis services for KSD 2652 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.