A3789/0160867
TL;DR: A3789/0160867 (CAS 727682-88-4) is a chemical compound with molecular formula C23H29N3O6 and molecular weight 443.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-[3-[4-(morpholine-4-carbonyl)piperidin-1-yl]-2,5-dioxopyrrolidin-1-yl]benzoate
Also Known As: A3789/0160867, ethyl 4-{3-[4-(morpholin-4-ylcarbonyl)piperidin-1-yl]-2,5-dioxopyrrolidin-1-yl}benzoate, ethyl 4-(3-(4-(morpholine-4-carbonyl)piperidin-1-yl)-2,5-dioxopyrrolidin-1-yl)benzoate, ethyl 4-[3-[4-(morpholine-4-carbonyl)piperidin-1-yl]-2,5-dioxopyrrolidin-1-yl]benzoate, ETHYL 4-{3-[4-(MORPHOLINOCARBONYL)PIPERIDINO]-2,5-DIOXO-1-PYRROLIDINYL}BENZOATE
| Molecular Formula | C23H29N3O6 |
|---|---|
| Molecular Weight | 443.21 g/mol |
| LogP | 1.066 |
| Topological Polar Surface Area | 96.46 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 443.20563 |
| Heavy Atoms | 32 |
| Complexity | 872.22284 |
Chemical Identifiers
| CAS Number | 727682-88-4 |
|---|---|
| SMILES | CCOC(=O)C1=CC=C(C=C1)N2C(=O)CC(C2=O)N3CCC(CC3)C(=O)N4CCOCC4 |
Product Overview
A3789/0160867 (CAS 727682-88-4), with molecular formula C23H29N3O6 and molecular weight 443.21 g/mol. IUPAC: ethyl 4-[3-[4-(morpholine-4-carbonyl)piperidin-1-yl]-2,5-dioxopyrrolidin-1-yl]benzoate.
Chemical Property Profile of A3789/0160867
Property Insights of A3789/0160867
The XLogP value of 1.066 suggests moderate lipophilicity, balancing water solubility and membrane permeability for A3789/0160867. The TPSA of 96.46 Ų falls within the moderate polarity range, balancing permeability and solubility for A3789/0160867. Following Lipinski's Rule of Five, A3789/0160867 has 0 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 A3789/0160867?
The CAS number of A3789/0160867 is 727682-88-4.
What is the molecular formula of A3789/0160867?
The molecular formula of A3789/0160867 is C23H29N3O6.
What is the molecular weight of A3789/0160867?
The molecular weight of A3789/0160867 is 443.21 g/mol.
Where can I buy A3789/0160867?
You can request a quote for A3789/0160867 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A3789/0160867?
Yes, KEHONG BIO provides custom synthesis services for A3789/0160867 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.