8X-0090
TL;DR: 8X-0090 (CAS 956741-73-4) is a chemical compound with molecular formula C27H29Cl2N3O4 and molecular weight 529.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tert-butyl 4-[5-(2,4-dichlorophenyl)-1-(4-methoxybenzoyl)pyrazol-3-yl]piperidine-1-carboxylate
Also Known As: 8X-0090, Tert-butyl 4-[5-(2,4-dichlorophenyl)-1-(4-methoxybenzoyl)pyrazol-3-yl]piperidine-1-carboxylate, tert-butyl 4-[5-(2,4-dichlorophenyl)-1-(4-methoxybenzoyl)-1H-pyrazol-3-yl]tetrahydro-1(2H)-pyridinecarboxylate, tert-butyl 4-[5-(2,4-dichlorophenyl)-1-(4-methoxybenzoyl)-1H-pyrazol-3-yl]piperidine-1-carboxylate
| Molecular Formula | C27H29Cl2N3O4 |
|---|---|
| Molecular Weight | 529.15 g/mol |
| LogP | 6.6685 |
| Topological Polar Surface Area | 73.66 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 529.1535 |
| Heavy Atoms | 36 |
| Complexity | 1257.0134 |
Chemical Identifiers
| CAS Number | 956741-73-4 |
|---|---|
| SMILES | CC(C)(C)OC(=O)N1CCC(CC1)C2=NN(C(=C2)C3=C(C=C(C=C3)Cl)Cl)C(=O)C4=CC=C(C=C4)OC |
Product Overview
8X-0090 (CAS 956741-73-4), with molecular formula C27H29Cl2N3O4 and molecular weight 529.15 g/mol. IUPAC: tert-butyl 4-[5-(2,4-dichlorophenyl)-1-(4-methoxybenzoyl)pyrazol-3-yl]piperidine-1-carboxylate.
Chemical Property Profile of 8X-0090
Property Insights of 8X-0090
The XLogP value of 6.6685 indicates that 8X-0090 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 73.66 Ų falls within the moderate polarity range, balancing permeability and solubility for 8X-0090. Following Lipinski's Rule of Five, 8X-0090 has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 8X-0090?
The CAS number of 8X-0090 is 956741-73-4.
What is the molecular formula of 8X-0090?
The molecular formula of 8X-0090 is C27H29Cl2N3O4.
What is the molecular weight of 8X-0090?
The molecular weight of 8X-0090 is 529.15 g/mol.
Where can I buy 8X-0090?
You can request a quote for 8X-0090 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 8X-0090?
Yes, KEHONG BIO provides custom synthesis services for 8X-0090 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.