EINECS 261-268-4
TL;DR: EINECS 261-268-4 (CAS 58470-73-8) is a chemical compound with molecular formula C24H17N3O4 and molecular weight 411.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(6-benzoylbenzo[cd]indol-2-yl)-6-hydroxy-1,3-dimethylpyrimidine-2,4-dione
Also Known As: 5-(6-Benzoylbenz(cd)indol-2(1H)-ylidene)-1,3-dimethyl-1H,3H,5H-pyrimidine-2,4,6-trione, 5-[6-benzoylbenz[cd]indol-2(1H)-ylidene]-1,3-dimethyl-1H,3H,5H-pyrimidine-2,4,6-trione, 2,4,6(1H,3H,5H)-Pyrimidinetrione, 5(6-benzoylbenz[cd]indol-2(1H)-ylidene)-1,3-dimethyl-, 2,4,6(1H,3H,5H)-Pyrimidinetrione,5-(6-benzoylbenz[cd]indol-2(1H)-ylidene)-1,3-dimethyl-, 5-(6-benzoyl-1H-benzo[cd]indol-2-ylidene)-1,3-dimethyl-1,3-diazinane-2,4,6-trione
| Molecular Formula | C24H17N3O4 |
|---|---|
| Molecular Weight | 411.12 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 90.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 411.12192 |
| Heavy Atoms | 31 |
| Complexity | 872.0 |
Chemical Identifiers
| CAS Number | 58470-73-8 |
|---|---|
| SMILES | CN1C(=C(C(=O)N(C1=O)C)C2=NC3=C4C2=CC=CC4=C(C=C3)C(=O)C5=CC=CC=C5)O |
| InChIKey | PJIWHFABSQBCGR-UHFFFAOYSA-N |
Product Overview
EINECS 261-268-4 (CAS 58470-73-8), with molecular formula C24H17N3O4 and molecular weight 411.12 g/mol. IUPAC: 5-(6-benzoylbenzo[cd]indol-2-yl)-6-hydroxy-1,3-dimethylpyrimidine-2,4-dione.
Chemical Property Profile of EINECS 261-268-4
Property Insights of EINECS 261-268-4
The XLogP value of 3.2 indicates that EINECS 261-268-4 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 90.3 Ų falls within the moderate polarity range, balancing permeability and solubility for EINECS 261-268-4. Following Lipinski's Rule of Five, EINECS 261-268-4 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 EINECS 261-268-4?
The CAS number of EINECS 261-268-4 is 58470-73-8.
What is the molecular formula of EINECS 261-268-4?
The molecular formula of EINECS 261-268-4 is C24H17N3O4.
What is the molecular weight of EINECS 261-268-4?
The molecular weight of EINECS 261-268-4 is 411.12 g/mol.
Where can I buy EINECS 261-268-4?
You can request a quote for EINECS 261-268-4 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for EINECS 261-268-4?
Yes, KEHONG BIO provides custom synthesis services for EINECS 261-268-4 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.