N-Succinyl-alanyl-methionyl-S-benzylcysteine-4-nitroanilide
TL;DR: N-Succinyl-alanyl-methionyl-S-benzylcysteine-4-nitroanilide (CAS 117823-37-7) is a chemical compound with molecular formula C28H35N5O8S2 and molecular weight 633.1927 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-[[(2S)-1-[[(2S)-1-[[(2R)-3-benzylsulfanyl-2-(4-nitroanilino)propanoyl]amino]-4-methylsulfanyl-1-oxobutan-2-yl]amino]-1-oxopropan-2-yl]amino]-4-oxobutanoic acid
Also Known As: SAMBN, N-Succinyl-alanyl-methionyl-S-benzylcysteine-4-nitroanilide, 4-[[(2S)-1-[[(2S)-1-[[(2R)-3-benzylsulfanyl-2-(4-nitroanilino)propanoyl]amino]-4-methylsulfanyl-1-oxobutan-2-yl]amino]-1-oxopropan-2-yl]amino]-4-oxobutanoic acid, N-(3-Carboxypropanoyl)-L-alanyl-N-[(2R)-3-(benzylsulfanyl)-2-(4-nitroanilino)propanoyl]-L-methioninamide
Technical Specifications
| Molecular Formula | C28H35N5O8S2 |
| Molecular Weight | 633.1927 g/mol |
| XLogP | 2.6 |
| Topological Polar Surface Area (TPSA) | 250.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 17 |
| Exact Mass | 633.1927 Da |
| Heavy Atoms | 43 |
| Complexity | 952.0 |
| SMILES | C[C@@H](C(=O)N[C@@H](CCSC)C(=O)NC(=O)[C@H](CSCC1=CC=CC=C1)NC2=CC=C(C=C2)[N+](=O)[O-])NC(=O)CCC(=O)O |
| InChIKey | ZXTNGMVBXFPSKT-TZYHBYERSA-N |
Chemical Property Profile of N-Succinyl-alanyl-methionyl-S-benzylcysteine-4-nitroanilide
Property Insights of N-Succinyl-alanyl-methionyl-S-benzylcysteine-4-nitroanilide
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-Succinyl-alanyl-methionyl-S-benzylcysteine-4-nitroanilide. The TPSA of 250.0 Ų indicates high polarity, suggesting N-Succinyl-alanyl-methionyl-S-benzylcysteine-4-nitroanilide may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, N-Succinyl-alanyl-methionyl-S-benzylcysteine-4-nitroanilide has 5 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of N-Succinyl-alanyl-methionyl-S-benzylcysteine-4-nitroanilide?
The CAS number of N-Succinyl-alanyl-methionyl-S-benzylcysteine-4-nitroanilide is 117823-37-7.
What is the molecular formula of N-Succinyl-alanyl-methionyl-S-benzylcysteine-4-nitroanilide?
The molecular formula of N-Succinyl-alanyl-methionyl-S-benzylcysteine-4-nitroanilide is C28H35N5O8S2.
What is the molecular weight of N-Succinyl-alanyl-methionyl-S-benzylcysteine-4-nitroanilide?
The molecular weight of N-Succinyl-alanyl-methionyl-S-benzylcysteine-4-nitroanilide is 633.1927 g/mol.
Where can I buy N-Succinyl-alanyl-methionyl-S-benzylcysteine-4-nitroanilide?
You can request a quote for N-Succinyl-alanyl-methionyl-S-benzylcysteine-4-nitroanilide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for N-Succinyl-alanyl-methionyl-S-benzylcysteine-4-nitroanilide?
Yes, CoreyChem provides custom synthesis services for N-Succinyl-alanyl-methionyl-S-benzylcysteine-4-nitroanilide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.