(5-Cinnamido-4-oxo-6-phenylhexanoyl)prolyl-proline
TL;DR: (5-Cinnamido-4-oxo-6-phenylhexanoyl)prolyl-proline (CAS 121822-29-5) is a chemical compound with molecular formula C31H35N3O6 and molecular weight 545.25256 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2S)-1-[(2S)-1-[4-oxo-6-phenyl-5-[[(E)-3-phenylprop-2-enoyl]amino]hexanoyl]pyrrolidine-2-carbonyl]pyrrolidine-2-carboxylic acid
Also Known As: Cinnamoyl-phe-(C)gly-pro-pro, (5-Cinnamido-4-oxo-6-phenylhexanoyl)prolyl-proline, (2S)-1-[(2S)-1-[4-oxo-6-phenyl-5-[[(E)-3-phenylprop-2-enoyl]amino]hexanoyl]pyrrolidine-2-carbonyl]pyrrolidine-2-carboxylic acid
Technical Specifications
| Molecular Formula | C31H35N3O6 |
| Molecular Weight | 545.25256 g/mol |
| XLogP | 2.9 |
| Topological Polar Surface Area (TPSA) | 124.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 11 |
| Exact Mass | 545.25256 Da |
| Heavy Atoms | 40 |
| Complexity | 953.0 |
| SMILES | C1C[C@H](N(C1)C(=O)CCC(=O)C(CC2=CC=CC=C2)NC(=O)/C=C/C3=CC=CC=C3)C(=O)N4CCC[C@H]4C(=O)O |
| InChIKey | DMQWIWWUQXRXSS-KNDPRKAVSA-N |
Chemical Property Profile of (5-Cinnamido-4-oxo-6-phenylhexanoyl)prolyl-proline
Property Insights of (5-Cinnamido-4-oxo-6-phenylhexanoyl)prolyl-proline
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (5-Cinnamido-4-oxo-6-phenylhexanoyl)prolyl-proline. The TPSA of 124.0 Ų falls within the moderate polarity range, balancing permeability and solubility for (5-Cinnamido-4-oxo-6-phenylhexanoyl)prolyl-proline. Following Lipinski's Rule of Five, (5-Cinnamido-4-oxo-6-phenylhexanoyl)prolyl-proline has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of (5-Cinnamido-4-oxo-6-phenylhexanoyl)prolyl-proline?
The CAS number of (5-Cinnamido-4-oxo-6-phenylhexanoyl)prolyl-proline is 121822-29-5.
What is the molecular formula of (5-Cinnamido-4-oxo-6-phenylhexanoyl)prolyl-proline?
The molecular formula of (5-Cinnamido-4-oxo-6-phenylhexanoyl)prolyl-proline is C31H35N3O6.
What is the molecular weight of (5-Cinnamido-4-oxo-6-phenylhexanoyl)prolyl-proline?
The molecular weight of (5-Cinnamido-4-oxo-6-phenylhexanoyl)prolyl-proline is 545.25256 g/mol.
Where can I buy (5-Cinnamido-4-oxo-6-phenylhexanoyl)prolyl-proline?
You can request a quote for (5-Cinnamido-4-oxo-6-phenylhexanoyl)prolyl-proline directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for (5-Cinnamido-4-oxo-6-phenylhexanoyl)prolyl-proline?
Yes, CoreyChem provides custom synthesis services for (5-Cinnamido-4-oxo-6-phenylhexanoyl)prolyl-proline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.