DivK1c_005876
TL;DR: DivK1c_005876 (CAS 473564-94-2) is a chemical compound with molecular formula C25H37NO6 and molecular weight 447.26 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ditert-butyl 2-[4-(dimethylamino)phenyl]-4-hydroxy-4-methyl-6-oxocyclohexane-1,3-dicarboxylate
Also Known As: DivK1c_005876, CDS1_004836, BAS 01157143, BIM-0036609.P001, AB00103819-01
| Molecular Formula | C25H37NO6 |
|---|---|
| Molecular Weight | 447.26 g/mol |
| LogP | 3.4758 |
| Topological Polar Surface Area | 93.14 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 447.2621 |
| Heavy Atoms | 32 |
| Complexity | 857.9037 |
Chemical Identifiers
| CAS Number | 473564-94-2 |
|---|---|
| SMILES | CC1(CC(=O)C(C(C1C(=O)OC(C)(C)C)C2=CC=C(C=C2)N(C)C)C(=O)OC(C)(C)C)O |
Product Overview
DivK1c_005876 (CAS 473564-94-2), with molecular formula C25H37NO6 and molecular weight 447.26 g/mol. IUPAC: ditert-butyl 2-[4-(dimethylamino)phenyl]-4-hydroxy-4-methyl-6-oxocyclohexane-1,3-dicarboxylate.
Chemical Property Profile of DivK1c_005876
Property Insights of DivK1c_005876
The XLogP value of 3.4758 indicates that DivK1c_005876 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 93.14 Ų falls within the moderate polarity range, balancing permeability and solubility for DivK1c_005876. Following Lipinski's Rule of Five, DivK1c_005876 has 1 hydrogen bond donor(s) and 7 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 DivK1c_005876?
The CAS number of DivK1c_005876 is 473564-94-2.
What is the molecular formula of DivK1c_005876?
The molecular formula of DivK1c_005876 is C25H37NO6.
What is the molecular weight of DivK1c_005876?
The molecular weight of DivK1c_005876 is 447.26 g/mol.
Where can I buy DivK1c_005876?
You can request a quote for DivK1c_005876 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for DivK1c_005876?
Yes, KEHONG BIO provides custom synthesis services for DivK1c_005876 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.