3-Isopropyl-5,7-dimorpholinomethyltropolone
TL;DR: 3-Isopropyl-5,7-dimorpholinomethyltropolone (CAS 34723-12-1) is a chemical compound with molecular formula C20H30N2O4 and molecular weight 362.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-hydroxy-3,5-bis(morpholin-4-ylmethyl)-7-propan-2-ylcyclohepta-2,4,6-trien-1-one
Also Known As: 3-Isopropyl-5,7-dimorpholinomethyltropolone, 5,7-Bis(morpholinomethyl)-2-hydroxy-3-isopropyl-2,4,6-cycloheptatrien-1-one, 3-isopropyl-5,7-bis-morpholin-4-ylmethyl-tropolone, 2-hydroxy-3,5-bis(morpholin-4-ylmethyl)-7-propan-2-ylcyclohepta-2,4,6-trien-1-one, 2-Hydroxy-3-isopropyl-5,7-bis -2,4,6-cycloheptatriene-1-one
| Molecular Formula | C20H30N2O4 |
|---|---|
| Molecular Weight | 362.22 g/mol |
| LogP | 0.6 |
| Topological Polar Surface Area | 62.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 362.22055 |
| Heavy Atoms | 26 |
| Complexity | 609.0 |
Chemical Identifiers
| CAS Number | 34723-12-1 |
|---|---|
| SMILES | CC(C)C1=CC(=CC(=C(C1=O)O)CN2CCOCC2)CN3CCOCC3 |
| InChIKey | SCLKVZOWUNRDIX-UHFFFAOYSA-N |
Product Overview
3-Isopropyl-5,7-dimorpholinomethyltropolone (CAS 34723-12-1), with molecular formula C20H30N2O4 and molecular weight 362.22 g/mol. IUPAC: 2-hydroxy-3,5-bis(morpholin-4-ylmethyl)-7-propan-2-ylcyclohepta-2,4,6-trien-1-one.
Chemical Property Profile of 3-Isopropyl-5,7-dimorpholinomethyltropolone
Property Insights of 3-Isopropyl-5,7-dimorpholinomethyltropolone
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Isopropyl-5,7-dimorpholinomethyltropolone. The TPSA of 62.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Isopropyl-5,7-dimorpholinomethyltropolone. Following Lipinski's Rule of Five, 3-Isopropyl-5,7-dimorpholinomethyltropolone has 1 hydrogen bond donor(s) and 6 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-Isopropyl-5,7-dimorpholinomethyltropolone?
The CAS number of 3-Isopropyl-5,7-dimorpholinomethyltropolone is 34723-12-1.
What is the molecular formula of 3-Isopropyl-5,7-dimorpholinomethyltropolone?
The molecular formula of 3-Isopropyl-5,7-dimorpholinomethyltropolone is C20H30N2O4.
What is the molecular weight of 3-Isopropyl-5,7-dimorpholinomethyltropolone?
The molecular weight of 3-Isopropyl-5,7-dimorpholinomethyltropolone is 362.22 g/mol.
Where can I buy 3-Isopropyl-5,7-dimorpholinomethyltropolone?
You can request a quote for 3-Isopropyl-5,7-dimorpholinomethyltropolone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Isopropyl-5,7-dimorpholinomethyltropolone?
Yes, KEHONG BIO provides custom synthesis services for 3-Isopropyl-5,7-dimorpholinomethyltropolone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.