(4e,4'e)-4,4'-[Iminobis(ethane-2,1-diylnitrilo)]bis(4-phenylbutan-2-one)
TL;DR: (4e,4'e)-4,4'-[Iminobis(ethane-2,1-diylnitrilo)]bis(4-phenylbutan-2-one) (CAS 88511-72-2) is a chemical compound with molecular formula C24H29N3O2 and molecular weight 391.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[2-[2-[(3-oxo-1-phenylbutylidene)amino]ethylamino]ethylimino]-4-phenylbutan-2-one
Also Known As: KST-1A8718, (4e,4'e)-4,4'-[iminobis(ethane-2,1-diylnitrilo)]bis(4-phenylbutan-2-one), 4-[2-[2-[(3-oxo-1-phenylbutylidene)amino]ethylamino]ethylimi, (4E,4'E)-4,4'-[Azanediylbis(ethane-2,1-diylazanylylidene)]bis(4-phenylbutan-2-one), 4-[2-[2-[(3-oxo-1-phenylbutylidene)amino]ethylamino]ethylimino]-4-phenylbutan-2-one
| Molecular Formula | C24H29N3O2 |
|---|---|
| Molecular Weight | 391.23 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 70.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 12 |
| Exact Mass | 391.22598 |
| Heavy Atoms | 29 |
| Complexity | 521.0 |
Chemical Identifiers
| CAS Number | 88511-72-2 |
|---|---|
| SMILES | CC(=O)CC(=NCCNCCN=C(CC(=O)C)C1=CC=CC=C1)C2=CC=CC=C2 |
| InChIKey | MBUBOXPVOFNMDX-UHFFFAOYSA-N |
Product Overview
(4e,4'e)-4,4'-[Iminobis(ethane-2,1-diylnitrilo)]bis(4-phenylbutan-2-one) (CAS 88511-72-2), with molecular formula C24H29N3O2 and molecular weight 391.23 g/mol. IUPAC: 4-[2-[2-[(3-oxo-1-phenylbutylidene)amino]ethylamino]ethylimino]-4-phenylbutan-2-one.
Chemical Property Profile of (4e,4'e)-4,4'-[Iminobis(ethane-2,1-diylnitrilo)]bis(4-phenylbutan-2-one)
Property Insights of (4e,4'e)-4,4'-[Iminobis(ethane-2,1-diylnitrilo)]bis(4-phenylbutan-2-one)
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (4e,4'e)-4,4'-[Iminobis(ethane-2,1-diylnitrilo)]bis(4-phenylbutan-2-one). The TPSA of 70.9 Ų falls within the moderate polarity range, balancing permeability and solubility for (4e,4'e)-4,4'-[Iminobis(ethane-2,1-diylnitrilo)]bis(4-phenylbutan-2-one). Following Lipinski's Rule of Five, (4e,4'e)-4,4'-[Iminobis(ethane-2,1-diylnitrilo)]bis(4-phenylbutan-2-one) has 1 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 (4e,4'e)-4,4'-[Iminobis(ethane-2,1-diylnitrilo)]bis(4-phenylbutan-2-one)?
The CAS number of (4e,4'e)-4,4'-[Iminobis(ethane-2,1-diylnitrilo)]bis(4-phenylbutan-2-one) is 88511-72-2.
What is the molecular formula of (4e,4'e)-4,4'-[Iminobis(ethane-2,1-diylnitrilo)]bis(4-phenylbutan-2-one)?
The molecular formula of (4e,4'e)-4,4'-[Iminobis(ethane-2,1-diylnitrilo)]bis(4-phenylbutan-2-one) is C24H29N3O2.
What is the molecular weight of (4e,4'e)-4,4'-[Iminobis(ethane-2,1-diylnitrilo)]bis(4-phenylbutan-2-one)?
The molecular weight of (4e,4'e)-4,4'-[Iminobis(ethane-2,1-diylnitrilo)]bis(4-phenylbutan-2-one) is 391.23 g/mol.
Where can I buy (4e,4'e)-4,4'-[Iminobis(ethane-2,1-diylnitrilo)]bis(4-phenylbutan-2-one)?
You can request a quote for (4e,4'e)-4,4'-[Iminobis(ethane-2,1-diylnitrilo)]bis(4-phenylbutan-2-one) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (4e,4'e)-4,4'-[Iminobis(ethane-2,1-diylnitrilo)]bis(4-phenylbutan-2-one)?
Yes, KEHONG BIO provides custom synthesis services for (4e,4'e)-4,4'-[Iminobis(ethane-2,1-diylnitrilo)]bis(4-phenylbutan-2-one) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.