Acetylprolyl-alpha,beta-dehydrovaline methylamide
TL;DR: Acetylprolyl-alpha,beta-dehydrovaline methylamide (CAS 132168-80-0) is a chemical compound with molecular formula C13H21N3O3 and molecular weight 267.1583 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2S)-1-acetyl-N-[3-methyl-1-(methylamino)-1-oxobut-2-en-2-yl]pyrrolidine-2-carboxamide
Also Known As: Apdv-methylamide, Acetylprolyl-alpha,beta-dehydrovaline methylamide, Pyrimidine,5-bromo-2,4-diethoxy, Valinamide, 1-acetyl-L-prolyl-2,3-didehydro-N-methyl-, (2S)-1-acetyl-N-[3-methyl-1-(methylamino)-1-oxobut-2-en-2-yl]pyrrolidine-2-carboxamide
Technical Specifications
| Molecular Formula | C13H21N3O3 |
| Molecular Weight | 267.1583 g/mol |
| XLogP | -0.4 |
| Topological Polar Surface Area (TPSA) | 78.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 267.1583 Da |
| Heavy Atoms | 19 |
| Complexity | 425.0 |
| SMILES | CC(=C(C(=O)NC)NC(=O)[C@@H]1CCCN1C(=O)C)C |
| InChIKey | KBMKJMVWDGLMCB-JTQLQIEISA-N |
Chemical Property Profile of Acetylprolyl-alpha,beta-dehydrovaline methylamide
Property Insights of Acetylprolyl-alpha,beta-dehydrovaline methylamide
The XLogP value of -0.4 indicates that Acetylprolyl-alpha,beta-dehydrovaline methylamide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 78.5 Ų falls within the moderate polarity range, balancing permeability and solubility for Acetylprolyl-alpha,beta-dehydrovaline methylamide. Following Lipinski's Rule of Five, Acetylprolyl-alpha,beta-dehydrovaline methylamide 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 Acetylprolyl-alpha,beta-dehydrovaline methylamide?
The CAS number of Acetylprolyl-alpha,beta-dehydrovaline methylamide is 132168-80-0.
What is the molecular formula of Acetylprolyl-alpha,beta-dehydrovaline methylamide?
The molecular formula of Acetylprolyl-alpha,beta-dehydrovaline methylamide is C13H21N3O3.
What is the molecular weight of Acetylprolyl-alpha,beta-dehydrovaline methylamide?
The molecular weight of Acetylprolyl-alpha,beta-dehydrovaline methylamide is 267.1583 g/mol.
Where can I buy Acetylprolyl-alpha,beta-dehydrovaline methylamide?
You can request a quote for Acetylprolyl-alpha,beta-dehydrovaline methylamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Acetylprolyl-alpha,beta-dehydrovaline methylamide?
Yes, CoreyChem provides custom synthesis services for Acetylprolyl-alpha,beta-dehydrovaline methylamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.