Opera_ID_844
TL;DR: Opera_ID_844 (CAS 131527-32-7) is a chemical compound with molecular formula C22H24N4O and molecular weight 360.195 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2E)-2-cyano-2-(14,21-diazapentacyclo[12.7.0.01,6.08,13.015,20]henicosa-8(13),15,18,20-tetraen-17-ylidene)acetamide
Also Known As: (2E)-2-cyano-2-(6,7,8,9,9a,10,11,12,13,14-decahydro-2H-benzimidazo[2,1-e]acridin-2-ylidene)ethanamide, (E)-2-cyano-2-(6,7,8,9,9a,10,11,12,13,14-decahydro-2H-benzo[4,5]imidazo[2,1-e]acridin-2-ylidene)acetamide, Opera_ID_844, REGID_for_CID_5848270
Technical Specifications
| Molecular Formula | C22H24N4O |
| Molecular Weight | 360.195 g/mol |
| XLogP | 2.5 |
| Topological Polar Surface Area (TPSA) | 82.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 360.195 Da |
| Heavy Atoms | 27 |
| Complexity | 939.0 |
| SMILES | C1CCC23C(C1)CC4=C(N2C5=C/C(=C(\C#N)/C(=O)N)/C=CC5=N3)CCCC4 |
| InChIKey | OHWJDSSZXTZAES-SAPNQHFASA-N |
Chemical Property Profile of Opera_ID_844
Property Insights of Opera_ID_844
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Opera_ID_844. The TPSA of 82.5 Ų falls within the moderate polarity range, balancing permeability and solubility for Opera_ID_844. Following Lipinski's Rule of Five, Opera_ID_844 has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Opera_ID_844?
The CAS number of Opera_ID_844 is 131527-32-7.
What is the molecular formula of Opera_ID_844?
The molecular formula of Opera_ID_844 is C22H24N4O.
What is the molecular weight of Opera_ID_844?
The molecular weight of Opera_ID_844 is 360.195 g/mol.
Where can I buy Opera_ID_844?
You can request a quote for Opera_ID_844 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Opera_ID_844?
Yes, CoreyChem provides custom synthesis services for Opera_ID_844 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.