A3966/0169019
TL;DR: A3966/0169019 (CAS 878981-94-3) is a chemical compound with molecular formula C24H27N3O5 and molecular weight 437.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[4-(1,3-benzodioxol-5-ylamino)piperidin-1-yl]-1-[(4-methoxyphenyl)methyl]pyrrolidine-2,5-dione
Also Known As: A3966/0169019, 3-[4-(1,3-benzodioxol-5-ylamino)piperidin-1-yl]-1-(4-methoxybenzyl)pyrrolidine-2,5-dione, 3-[4-(1,3-benzodioxol-5-ylamino)piperidin-1-yl]-1-[(4-methoxyphenyl)methyl]pyrrolidine-2,5-dione, 3-[4-(1,3-BENZODIOXOL-5-YLAMINO)PIPERIDINO]-1-(4-METHOXYBENZYL)DIHYDRO-1H-PYRROLE-2,5-DIONE
| Molecular Formula | C24H27N3O5 |
|---|---|
| Molecular Weight | 437.20 g/mol |
| LogP | 2.6279 |
| Topological Polar Surface Area | 80.34 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 437.19507 |
| Heavy Atoms | 32 |
| Complexity | 1001.19434 |
Chemical Identifiers
| CAS Number | 878981-94-3 |
|---|---|
| SMILES | COC1=CC=C(C=C1)CN2C(=O)CC(C2=O)N3CCC(CC3)NC4=CC5=C(C=C4)OCO5 |
Product Overview
A3966/0169019 (CAS 878981-94-3), with molecular formula C24H27N3O5 and molecular weight 437.20 g/mol. IUPAC: 3-[4-(1,3-benzodioxol-5-ylamino)piperidin-1-yl]-1-[(4-methoxyphenyl)methyl]pyrrolidine-2,5-dione.
Chemical Property Profile of A3966/0169019
Property Insights of A3966/0169019
The XLogP value of 2.6279 suggests moderate lipophilicity, balancing water solubility and membrane permeability for A3966/0169019. The TPSA of 80.34 Ų falls within the moderate polarity range, balancing permeability and solubility for A3966/0169019. Following Lipinski's Rule of Five, A3966/0169019 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 A3966/0169019?
The CAS number of A3966/0169019 is 878981-94-3.
What is the molecular formula of A3966/0169019?
The molecular formula of A3966/0169019 is C24H27N3O5.
What is the molecular weight of A3966/0169019?
The molecular weight of A3966/0169019 is 437.20 g/mol.
Where can I buy A3966/0169019?
You can request a quote for A3966/0169019 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A3966/0169019?
Yes, KEHONG BIO provides custom synthesis services for A3966/0169019 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.