N,N'-bis-Cbz-beta-Alethine
TL;DR: N,N'-bis-Cbz-beta-Alethine (CAS 104071-84-3) is a chemical compound with molecular formula C26H34N4O6S2 and molecular weight 562.19196 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
benzyl N-[3-oxo-3-[2-[2-[3-(phenylmethoxycarbonylamino)propanoylamino]ethyldisulfanyl]ethylamino]propyl]carbamate
Also Known As: N,N'-bis-Cbz-beta-Alethine, N,N?-bis-Cbz-?-Alethine, N,N inverted exclamation mark -bis-Cbz-, A-Alethine, benzyl N-[3-oxo-3-[2-[2-[3-(phenylmethoxycarbonylamino)propanoylamino]ethyldisulfanyl]ethylamino]propyl]carbamate
Technical Specifications
| Molecular Formula | C26H34N4O6S2 |
| Molecular Weight | 562.19196 g/mol |
| XLogP | 1.8 |
| Topological Polar Surface Area (TPSA) | 185.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 19 |
| Exact Mass | 562.19196 Da |
| Heavy Atoms | 38 |
| Complexity | 645.0 |
| SMILES | C1=CC=C(C=C1)COC(=O)NCCC(=O)NCCSSCCNC(=O)CCNC(=O)OCC2=CC=CC=C2 |
| InChIKey | QNRYOCUKPBROPJ-UHFFFAOYSA-N |
Chemical Property Profile of N,N'-bis-Cbz-beta-Alethine
Property Insights of N,N'-bis-Cbz-beta-Alethine
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N,N'-bis-Cbz-beta-Alethine. The TPSA of 185.0 Ų indicates high polarity, suggesting N,N'-bis-Cbz-beta-Alethine may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, N,N'-bis-Cbz-beta-Alethine has 4 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of N,N'-bis-Cbz-beta-Alethine?
The CAS number of N,N'-bis-Cbz-beta-Alethine is 104071-84-3.
What is the molecular formula of N,N'-bis-Cbz-beta-Alethine?
The molecular formula of N,N'-bis-Cbz-beta-Alethine is C26H34N4O6S2.
What is the molecular weight of N,N'-bis-Cbz-beta-Alethine?
The molecular weight of N,N'-bis-Cbz-beta-Alethine is 562.19196 g/mol.
Where can I buy N,N'-bis-Cbz-beta-Alethine?
You can request a quote for N,N'-bis-Cbz-beta-Alethine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for N,N'-bis-Cbz-beta-Alethine?
Yes, CoreyChem provides custom synthesis services for N,N'-bis-Cbz-beta-Alethine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.