TL;DR: 1-[(7-hydroxy-4-oxo-3-phenoxy-4H-chromen-8-yl)methyl]-D-proline (CAS 1212431-21-4) is a chemical compound with molecular formula C21H19NO6 and molecular weight 381.12125 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2R)-1-[(7-hydroxy-4-oxo-3-phenoxychromen-8-yl)methyl]pyrrolidine-2-carboxylic acid
Also Known As: 1-[(7-hydroxy-4-oxo-3-phenoxy-4H-chromen-8-yl)methyl]-D-proline, (2R)-1-[(7-hydroxy-4-oxo-3-phenoxychromen-8-yl)methyl]pyrrolidine-2-carboxylic acid, (R)-1-((7-hydroxy-4-oxo-3-phenoxy-4H-chromen-8-yl)methyl)pyrrolidine-2-carboxylic acid
| Molecular Formula | C21H19NO6 |
| Molecular Weight | 381.12125 g/mol |
| XLogP | 1.2 |
| Topological Polar Surface Area (TPSA) | 100.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 381.12125 Da |
| Heavy Atoms | 28 |
| Complexity | 623.0 |
| SMILES | C1C[C@@H](N(C1)CC2=C(C=CC3=C2OC=C(C3=O)OC4=CC=CC=C4)O)C(=O)O |
| InChIKey | CUDSZBUCKSGWDD-MRXNPFEDSA-N |
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-[(7-hydroxy-4-oxo-3-phenoxy-4H-chromen-8-yl)methyl]-D-proline. The TPSA of 100.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-[(7-hydroxy-4-oxo-3-phenoxy-4H-chromen-8-yl)methyl]-D-proline. Following Lipinski's Rule of Five, 1-[(7-hydroxy-4-oxo-3-phenoxy-4H-chromen-8-yl)methyl]-D-proline has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 1-[(7-hydroxy-4-oxo-3-phenoxy-4H-chromen-8-yl)methyl]-D-proline is 1212431-21-4.
The molecular formula of 1-[(7-hydroxy-4-oxo-3-phenoxy-4H-chromen-8-yl)methyl]-D-proline is C21H19NO6.
The molecular weight of 1-[(7-hydroxy-4-oxo-3-phenoxy-4H-chromen-8-yl)methyl]-D-proline is 381.12125 g/mol.
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