N-Ac-Ala-ala-pro-ala-amc
TL;DR: N-Ac-Ala-ala-pro-ala-amc (CAS 62037-45-0) is a chemical compound with molecular formula C26H33N5O7 and molecular weight 527.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-1-[(2S)-2-[[(2S)-2-acetamidopropanoyl]amino]propanoyl]-N-[(2S)-1-[(4-methyl-2-oxochromen-7-yl)amino]-1-oxopropan-2-yl]pyrrolidine-2-carboxamide
Also Known As: N-Ac-Ala-ala-pro-ala-amc, N-Acetyl-alanyl-alanyl-prolyl-alanyl-amidomethylcoumarin, (2S)-1-[(2S)-2-[[(2S)-2-acetamidopropanoyl]amino]propanoyl]-N-[(2S)-1-[(4-methyl-2-oxochromen-7-yl)amino]-1-oxopropan-2-yl]pyrrolidine-2-carboxamide, L-Alaninamide, N-acetyl-L-alanyl-L-alanyl-L-prolyl-N-(4-methyl-2-oxo-2H-1-benzopyran-7-yl)-
| Molecular Formula | C26H33N5O7 |
|---|---|
| Molecular Weight | 527.24 g/mol |
| LogP | 0.56492 |
| Topological Polar Surface Area | 166.92 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 527.238 |
| Heavy Atoms | 38 |
| Complexity | 1320.7986 |
Chemical Identifiers
| CAS Number | 62037-45-0 |
|---|---|
| SMILES | CC1=CC(=O)OC2=C1C=CC(=C2)NC(=O)[C@H](C)NC(=O)[C@@H]3CCCN3C(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)C |
Product Overview
N-Ac-Ala-ala-pro-ala-amc (CAS 62037-45-0), with molecular formula C26H33N5O7 and molecular weight 527.24 g/mol. IUPAC: (2S)-1-[(2S)-2-[[(2S)-2-acetamidopropanoyl]amino]propanoyl]-N-[(2S)-1-[(4-methyl-2-oxochromen-7-yl)amino]-1-oxopropan-2-yl]pyrrolidine-2-carboxamide.
Chemical Property Profile of N-Ac-Ala-ala-pro-ala-amc
Property Insights of N-Ac-Ala-ala-pro-ala-amc
The XLogP value of 0.56492 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-Ac-Ala-ala-pro-ala-amc. The TPSA of 166.92 Ų indicates high polarity, suggesting N-Ac-Ala-ala-pro-ala-amc may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, N-Ac-Ala-ala-pro-ala-amc has 4 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-Ac-Ala-ala-pro-ala-amc?
The CAS number of N-Ac-Ala-ala-pro-ala-amc is 62037-45-0.
What is the molecular formula of N-Ac-Ala-ala-pro-ala-amc?
The molecular formula of N-Ac-Ala-ala-pro-ala-amc is C26H33N5O7.
What is the molecular weight of N-Ac-Ala-ala-pro-ala-amc?
The molecular weight of N-Ac-Ala-ala-pro-ala-amc is 527.24 g/mol.
Where can I buy N-Ac-Ala-ala-pro-ala-amc?
You can request a quote for N-Ac-Ala-ala-pro-ala-amc directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-Ac-Ala-ala-pro-ala-amc?
Yes, KEHONG BIO provides custom synthesis services for N-Ac-Ala-ala-pro-ala-amc and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.