3-Hydroxygepirone
TL;DR: 3-Hydroxygepirone (CAS 345894-78-2) is a chemical compound with molecular formula C19H29N5O3 and molecular weight 375.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-hydroxy-4,4-dimethyl-1-[4-(4-pyrimidin-2-ylpiperazin-1-yl)butyl]piperidine-2,6-dione
Also Known As: 3-Hydroxygepirone, 3-Hydroxy Gepirone, 3-OH-gepirone, J1.095.544K, N0001-008133
| Molecular Formula | C19H29N5O3 |
|---|---|
| Molecular Weight | 375.23 g/mol |
| LogP | 0.5248 |
| Topological Polar Surface Area | 89.87 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 375.22705 |
| Heavy Atoms | 27 |
| Complexity | 658.5688 |
Chemical Identifiers
| CAS Number | 345894-78-2 |
|---|---|
| SMILES | CC1(CC(=O)N(C(=O)C1O)CCCCN2CCN(CC2)C3=NC=CC=N3)C |
Product Overview
3-Hydroxygepirone (CAS 345894-78-2), with molecular formula C19H29N5O3 and molecular weight 375.23 g/mol. IUPAC: 3-hydroxy-4,4-dimethyl-1-[4-(4-pyrimidin-2-ylpiperazin-1-yl)butyl]piperidine-2,6-dione.
Chemical Property Profile of 3-Hydroxygepirone
Property Insights of 3-Hydroxygepirone
The XLogP value of 0.5248 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Hydroxygepirone. The TPSA of 89.87 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Hydroxygepirone. Following Lipinski's Rule of Five, 3-Hydroxygepirone 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 3-Hydroxygepirone?
The CAS number of 3-Hydroxygepirone is 345894-78-2.
What is the molecular formula of 3-Hydroxygepirone?
The molecular formula of 3-Hydroxygepirone is C19H29N5O3.
What is the molecular weight of 3-Hydroxygepirone?
The molecular weight of 3-Hydroxygepirone is 375.23 g/mol.
Where can I buy 3-Hydroxygepirone?
You can request a quote for 3-Hydroxygepirone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Hydroxygepirone?
Yes, KEHONG BIO provides custom synthesis services for 3-Hydroxygepirone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.