N(alpha)-Acetylasparaginyl-lysyl-N(epsilon)-4-azidobenzoyl-threoninamide
(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
| Molecular Formula | C23H33N9O7 |
|---|---|
| Molecular Weight | 547.2503 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 |
| Monoisotopic 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 547.2503 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.
N(alpha)-Acetylasparaginyl-lysyl-N(epsilon)-4-azidobenzoyl-threoninamide is a custom synthesis product. We offer services from milligram to kilogram scale.
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