RefChem:1076099
TL;DR: RefChem:1076099 (CAS 112392-98-0) is a chemical compound with molecular formula C23H28N2O4 and molecular weight 396.2049 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(Z)-3-[2-[3-(diethylamino)propylcarbamoyl]phenyl]-2-hydroxy-3-phenylprop-2-enoic acid
Also Known As: 3-(o-((3-(Diethylamino)propyl)carbamoyl)phenyl)-2-hydroxy-3-phenylacrylic acid, Acrylic acid, 3-(o-((3-(diethylamino)propyl)carbamoyl)phenyl)-2-hydroxy-3-phenyl-, 2-Propenoic acid, 3-(2-(((3-(diethylamino)propyl)amino)carbonyl)phenyl)-2-hydroxy-3-phenyl-, (Z)-3-[2-[3-(diethylamino)propylcarbamoyl]phenyl]-2-hydroxy-3-phenylprop-2-enoic acid
Technical Specifications
| Molecular Formula | C23H28N2O4 |
| Molecular Weight | 396.2049 g/mol |
| XLogP | 1.7 |
| Topological Polar Surface Area (TPSA) | 89.9 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 10 |
| Exact Mass | 396.2049 Da |
| Heavy Atoms | 29 |
| Complexity | 565.0 |
| SMILES | CCN(CC)CCCNC(=O)C1=CC=CC=C1/C(=C(/C(=O)O)\O)/C2=CC=CC=C2 |
| InChIKey | SODKWJLSBALYMP-MRCUWXFGSA-N |
Chemical Property Profile of RefChem:1076099
Property Insights of RefChem:1076099
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:1076099. The TPSA of 89.9 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:1076099. Following Lipinski's Rule of Five, RefChem:1076099 has 3 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of RefChem:1076099?
The CAS number of RefChem:1076099 is 112392-98-0.
What is the molecular formula of RefChem:1076099?
The molecular formula of RefChem:1076099 is C23H28N2O4.
What is the molecular weight of RefChem:1076099?
The molecular weight of RefChem:1076099 is 396.2049 g/mol.
Where can I buy RefChem:1076099?
You can request a quote for RefChem:1076099 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for RefChem:1076099?
Yes, CoreyChem provides custom synthesis services for RefChem:1076099 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.