A3789/0160865
TL;DR: A3789/0160865 (CAS 727682-86-2) is a chemical compound with molecular formula C23H31N3O4 and molecular weight 413.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[4-(azepane-1-carbonyl)piperidin-1-yl]-1-(4-methoxyphenyl)pyrrolidine-2,5-dione
Also Known As: A3789/0160865, 3-[4-(azepan-1-ylcarbonyl)piperidin-1-yl]-1-(4-methoxyphenyl)pyrrolidine-2,5-dione, 3-[4-(azepane-1-carbonyl)piperidin-1-yl]-1-(4-methoxyphenyl)pyrrolidine-2,5-dione, 3-[4-(1-AZEPANYLCARBONYL)PIPERIDINO]-1-(4-METHOXYPHENYL)DIHYDRO-1H-PYRROLE-2,5-DIONE
| Molecular Formula | C23H31N3O4 |
|---|---|
| Molecular Weight | 413.23 g/mol |
| LogP | 2.4417 |
| Topological Polar Surface Area | 70.16 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 413.23145 |
| Heavy Atoms | 30 |
| Complexity | 778.1429 |
Chemical Identifiers
| CAS Number | 727682-86-2 |
|---|---|
| SMILES | COC1=CC=C(C=C1)N2C(=O)CC(C2=O)N3CCC(CC3)C(=O)N4CCCCCC4 |
Product Overview
A3789/0160865 (CAS 727682-86-2), with molecular formula C23H31N3O4 and molecular weight 413.23 g/mol. IUPAC: 3-[4-(azepane-1-carbonyl)piperidin-1-yl]-1-(4-methoxyphenyl)pyrrolidine-2,5-dione.
Chemical Property Profile of A3789/0160865
Property Insights of A3789/0160865
The XLogP value of 2.4417 suggests moderate lipophilicity, balancing water solubility and membrane permeability for A3789/0160865. The TPSA of 70.16 Ų falls within the moderate polarity range, balancing permeability and solubility for A3789/0160865. Following Lipinski's Rule of Five, A3789/0160865 has 0 hydrogen bond donor(s) and 5 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 A3789/0160865?
The CAS number of A3789/0160865 is 727682-86-2.
What is the molecular formula of A3789/0160865?
The molecular formula of A3789/0160865 is C23H31N3O4.
What is the molecular weight of A3789/0160865?
The molecular weight of A3789/0160865 is 413.23 g/mol.
Where can I buy A3789/0160865?
You can request a quote for A3789/0160865 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A3789/0160865?
Yes, KEHONG BIO provides custom synthesis services for A3789/0160865 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.