乙酰基-天冬酰胺酰-脯氨酰-甲基酪氨酰胺
TL;DR: 乙酰基-天冬酰胺酰-脯氨酰-甲基酪氨酰胺 (CAS 87919-33-3) is a chemical compound with molecular formula C21H29N5O6 and molecular weight 447.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
乙酰基-天冬酰胺酰-脯氨酰-甲基酪氨酰胺
(2S)-N-[(2S)-2-acetamido-3-(4-hydroxyphenyl)propanoyl]-1-[(2S)-2,4-diamino-4-oxobutanoyl]-N-methylpyrrolidine-2-carboxamide
Also Known As: Acetyl-asparaginyl-prolyl-methyltyrosinamide, N2-Acetyl-L-asparginyl-L-prolyl-N-methyl-L-tyrosinamide, L-Tyrosinamide, N2-acetyl-L-asparaginyl-L-prolyl-N-methyl-, L-Tyrosinamide, N2-acetyl-L-asparginyl-L-prolyl-N-methyl-, l-asparaginyl-n-[(2s)-2-(acetylamino)-3-(4-hydroxyphenyl)propanoyl]-n-methyl-l-prolinamide
| Molecular Formula | C21H29N5O6 |
|---|---|
| Molecular Weight | 447.21 g/mol |
| LogP | -1.5 |
| Topological Polar Surface Area | 176.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 447.2118 |
| Heavy Atoms | 32 |
| Complexity | 736.0 |
Chemical Identifiers
| CAS Number | 87919-33-3 |
|---|---|
| SMILES | CC(=O)N[C@@H](CC1=CC=C(C=C1)O)C(=O)N(C)C(=O)[C@@H]2CCCN2C(=O)[C@H](CC(=O)N)N |
| InChIKey | KTSBIEDXOOPHGM-ULQDDVLXSA-N |
Product Overview
乙酰基-天冬酰胺酰-脯氨酰-甲基酪氨酰胺 (CAS 87919-33-3), with molecular formula C21H29N5O6 and molecular weight 447.21 g/mol. IUPAC: (2S)-N-[(2S)-2-acetamido-3-(4-hydroxyphenyl)propanoyl]-1-[(2S)-2,4-diamino-4-oxobutanoyl]-N-methylpyrrolidine-2-carboxamide.
Chemical Property Profile of 乙酰基-天冬酰胺酰-脯氨酰-甲基酪氨酰胺
Property Insights of 乙酰基-天冬酰胺酰-脯氨酰-甲基酪氨酰胺
The XLogP value of -1.5 indicates that 乙酰基-天冬酰胺酰-脯氨酰-甲基酪氨酰胺 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 176.0 Ų indicates high polarity, suggesting 乙酰基-天冬酰胺酰-脯氨酰-甲基酪氨酰胺 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 乙酰基-天冬酰胺酰-脯氨酰-甲基酪氨酰胺 has 4 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 乙酰基-天冬酰胺酰-脯氨酰-甲基酪氨酰胺?
The CAS number of 乙酰基-天冬酰胺酰-脯氨酰-甲基酪氨酰胺 is 87919-33-3.
What is the molecular formula of 乙酰基-天冬酰胺酰-脯氨酰-甲基酪氨酰胺?
The molecular formula of 乙酰基-天冬酰胺酰-脯氨酰-甲基酪氨酰胺 is C21H29N5O6.
What is the molecular weight of 乙酰基-天冬酰胺酰-脯氨酰-甲基酪氨酰胺?
The molecular weight of 乙酰基-天冬酰胺酰-脯氨酰-甲基酪氨酰胺 is 447.21 g/mol.
Where can I buy 乙酰基-天冬酰胺酰-脯氨酰-甲基酪氨酰胺?
You can request a quote for 乙酰基-天冬酰胺酰-脯氨酰-甲基酪氨酰胺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 乙酰基-天冬酰胺酰-脯氨酰-甲基酪氨酰胺?
Yes, KEHONG BIO provides custom synthesis services for 乙酰基-天冬酰胺酰-脯氨酰-甲基酪氨酰胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.