RefChem:1084594
TL;DR: RefChem:1084594 (CAS 67367-69-5) is a chemical compound with molecular formula C24H29NO5 and molecular weight 411.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[bis(prop-2-enyl)amino]-1-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)ethanone;(E)-but-2-enedioic acid
Also Known As: Ethanone, 2-(di-2-propenylamino)-1-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)-, (Z)-2-butenedioate (1:1), 2-[bis(prop-2-enyl)amino]-1-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)ethanone; (E)-but-2-enedioic acid, RefChem:1084594
| Molecular Formula | C24H29NO5 |
|---|---|
| Molecular Weight | 411.20 g/mol |
| LogP | 3.2325 |
| Topological Polar Surface Area | 94.91 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 9 |
| Exact Mass | 411.20456 |
| Heavy Atoms | 30 |
| Complexity | 810.5875 |
Chemical Identifiers
| CAS Number | 67367-69-5 |
|---|---|
| SMILES | C=CCN(CC=C)CC(=O)C1=C2CCCC2=CC3=C1CCC3.C(=C/C(=O)O)\C(=O)O |
Product Overview
RefChem:1084594 (CAS 67367-69-5), with molecular formula C24H29NO5 and molecular weight 411.20 g/mol. IUPAC: 2-[bis(prop-2-enyl)amino]-1-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)ethanone;(E)-but-2-enedioic acid.
Chemical Property Profile of RefChem:1084594
Property Insights of RefChem:1084594
The XLogP value of 3.2325 indicates that RefChem:1084594 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 94.91 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:1084594. Following Lipinski's Rule of Five, RefChem:1084594 has 2 hydrogen bond donor(s) and 4 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 RefChem:1084594?
The CAS number of RefChem:1084594 is 67367-69-5.
What is the molecular formula of RefChem:1084594?
The molecular formula of RefChem:1084594 is C24H29NO5.
What is the molecular weight of RefChem:1084594?
The molecular weight of RefChem:1084594 is 411.20 g/mol.
Where can I buy RefChem:1084594?
You can request a quote for RefChem:1084594 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1084594?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1084594 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.