N(alpha)-Acetylasparaginyl-lysyl-N(epsilon)-4-azidobenzoyl-threoninamide
TL;DR: N(alpha)-Acetylasparaginyl-lysyl-N(epsilon)-4-azidobenzoyl-threoninamide (CAS 97530-18-2) is a chemical compound with molecular formula C23H33N9O7 and molecular weight 547.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2R)-2-acetamido-N-[(2S)-1-[[(2R,3R)-1-amino-3-hydroxy-1-oxobutan-2-yl]amino]-6-[(4-azidobenzoyl)amino]-1-oxohexan-2-yl]butanediamide
Also Known As: N-Ac-Asn-lys-azb-thr-NH2, N(alpha)-Acetylasparaginyl-lysyl-N(epsilon)-4-azidobenzoyl-threoninamide, N~2~-Acetyl-D-asparaginyl-N~6~-(4-azidobenzoyl)-L-lysyl-D-allothreoninamide, (2R)-2-acetamido-N-[(2S)-1-[[(2R,3R)-1-amino-3-hydroxy-1-oxobutan-2-yl]amino]-6-[(4-azidobenzoyl)amino]-1-oxohexan-2-yl]butanediamide, RefChem:160814
| Molecular Formula | C23H33N9O7 |
|---|---|
| Molecular Weight | 547.25 g/mol |
| LogP | -1.2557 |
| Topological Polar Surface Area | 271.57 Ų |
| Hydrogen Bond Donors | 7 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 16 |
| Exact Mass | 547.2503 |
| Heavy Atoms | 39 |
| Complexity | 1085.6685 |
Chemical Identifiers
| CAS Number | 97530-18-2 |
|---|---|
| SMILES | C[C@H]([C@H](C(=O)N)NC(=O)[C@H](CCCCNC(=O)C1=CC=C(C=C1)N=[N+]=[N-])NC(=O)[C@@H](CC(=O)N)NC(=O)C)O |
Product Overview
N(alpha)-Acetylasparaginyl-lysyl-N(epsilon)-4-azidobenzoyl-threoninamide (CAS 97530-18-2), with molecular formula C23H33N9O7 and molecular weight 547.25 g/mol. IUPAC: (2R)-2-acetamido-N-[(2S)-1-[[(2R,3R)-1-amino-3-hydroxy-1-oxobutan-2-yl]amino]-6-[(4-azidobenzoyl)amino]-1-oxohexan-2-yl]butanediamide.
Chemical Property Profile of N(alpha)-Acetylasparaginyl-lysyl-N(epsilon)-4-azidobenzoyl-threoninamide
Property Insights of N(alpha)-Acetylasparaginyl-lysyl-N(epsilon)-4-azidobenzoyl-threoninamide
The XLogP value of -1.2557 indicates that N(alpha)-Acetylasparaginyl-lysyl-N(epsilon)-4-azidobenzoyl-threoninamide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 271.57 Ų indicates high polarity, suggesting N(alpha)-Acetylasparaginyl-lysyl-N(epsilon)-4-azidobenzoyl-threoninamide may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, N(alpha)-Acetylasparaginyl-lysyl-N(epsilon)-4-azidobenzoyl-threoninamide has 7 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N(alpha)-Acetylasparaginyl-lysyl-N(epsilon)-4-azidobenzoyl-threoninamide?
The CAS number of N(alpha)-Acetylasparaginyl-lysyl-N(epsilon)-4-azidobenzoyl-threoninamide is 97530-18-2.
What is the molecular formula of N(alpha)-Acetylasparaginyl-lysyl-N(epsilon)-4-azidobenzoyl-threoninamide?
The molecular formula of N(alpha)-Acetylasparaginyl-lysyl-N(epsilon)-4-azidobenzoyl-threoninamide is C23H33N9O7.
What is the molecular weight of N(alpha)-Acetylasparaginyl-lysyl-N(epsilon)-4-azidobenzoyl-threoninamide?
The molecular weight of N(alpha)-Acetylasparaginyl-lysyl-N(epsilon)-4-azidobenzoyl-threoninamide is 547.25 g/mol.
Where can I buy N(alpha)-Acetylasparaginyl-lysyl-N(epsilon)-4-azidobenzoyl-threoninamide?
You can request a quote for N(alpha)-Acetylasparaginyl-lysyl-N(epsilon)-4-azidobenzoyl-threoninamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N(alpha)-Acetylasparaginyl-lysyl-N(epsilon)-4-azidobenzoyl-threoninamide?
Yes, KEHONG BIO provides custom synthesis services for N(alpha)-Acetylasparaginyl-lysyl-N(epsilon)-4-azidobenzoyl-threoninamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.