N-(2-Hydroxy-2-phenylethyl)-2H-1-benzopyran-3-carboximidic acid
TL;DR: N-(2-Hydroxy-2-phenylethyl)-2H-1-benzopyran-3-carboximidic acid (CAS 83823-15-8) is a chemical compound with molecular formula C18H17NO3 and molecular weight 295.12085 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-(2-hydroxy-2-phenylethyl)-2H-chromene-3-carboxamide
Also Known As: N-(2-Hydroxy-2-phenylethyl)-2H-1-benzopyran-3-carboxamide, 2H-1-BENZOPYRAN-3-CARBOXAMIDE, N-(2-HYDROXY-2-PHENYLETHYL)-, N-(2-Hydroxy-2-phenylethyl)-2H-1-benzopyran-3-carboximidic acid, N-(2-hydroxy-2-phenylethyl)-2H-chromene-3-carboxamide, BRN 4518590
Technical Specifications
| Molecular Formula | C18H17NO3 |
| Molecular Weight | 295.12085 g/mol |
| XLogP | 2.1 |
| Topological Polar Surface Area (TPSA) | 58.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 295.12085 Da |
| Heavy Atoms | 22 |
| Complexity | 415.0 |
| SMILES | C1C(=CC2=CC=CC=C2O1)C(=O)NCC(C3=CC=CC=C3)O |
| InChIKey | LGYVKNSGVBXEQD-UHFFFAOYSA-N |
Chemical Property Profile of N-(2-Hydroxy-2-phenylethyl)-2H-1-benzopyran-3-carboximidic acid
Property Insights of N-(2-Hydroxy-2-phenylethyl)-2H-1-benzopyran-3-carboximidic acid
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(2-Hydroxy-2-phenylethyl)-2H-1-benzopyran-3-carboximidic acid. With a topological polar surface area (TPSA) of 58.6 Ų, N-(2-Hydroxy-2-phenylethyl)-2H-1-benzopyran-3-carboximidic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(2-Hydroxy-2-phenylethyl)-2H-1-benzopyran-3-carboximidic acid has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of N-(2-Hydroxy-2-phenylethyl)-2H-1-benzopyran-3-carboximidic acid?
The CAS number of N-(2-Hydroxy-2-phenylethyl)-2H-1-benzopyran-3-carboximidic acid is 83823-15-8.
What is the molecular formula of N-(2-Hydroxy-2-phenylethyl)-2H-1-benzopyran-3-carboximidic acid?
The molecular formula of N-(2-Hydroxy-2-phenylethyl)-2H-1-benzopyran-3-carboximidic acid is C18H17NO3.
What is the molecular weight of N-(2-Hydroxy-2-phenylethyl)-2H-1-benzopyran-3-carboximidic acid?
The molecular weight of N-(2-Hydroxy-2-phenylethyl)-2H-1-benzopyran-3-carboximidic acid is 295.12085 g/mol.
Where can I buy N-(2-Hydroxy-2-phenylethyl)-2H-1-benzopyran-3-carboximidic acid?
You can request a quote for N-(2-Hydroxy-2-phenylethyl)-2H-1-benzopyran-3-carboximidic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for N-(2-Hydroxy-2-phenylethyl)-2H-1-benzopyran-3-carboximidic acid?
Yes, CoreyChem provides custom synthesis services for N-(2-Hydroxy-2-phenylethyl)-2H-1-benzopyran-3-carboximidic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.