Emd 52297
TL;DR: Emd 52297 (CAS 129049-51-0) is a chemical compound with molecular formula C39H59N11O7 and molecular weight 793.4599 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
tert-butyl N-[1-[[1-[[1-cyclohexyl-3-hydroxy-5-[[3-methyl-1-oxo-1-(tetrazol-2-ylmethylamino)pentan-2-yl]amino]-5-oxopentan-2-yl]amino]-3-(1H-imidazol-5-yl)-1-oxopropan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]carbamate
Also Known As: EMD 52297, QUIPAZINE,6-NITRO-MALEATE, tert-butyl N-[1-[[1-[[1-cyclohexyl-3-hydroxy-5-[[3-methyl-1-oxo-1-(tetrazol-2-ylmethylamino)pentan-2-yl]amino]-5-oxopentan-2-yl]amino]-3-(1H-imidazol-5-yl)-1-oxopropan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]carbamate, N-(tert-Butoxycarbonal)-phenylalanyl-histidyl-(4-amino-3-hydroxy-5-cyclohexyl)-pentacarbonyl-isoleucyl-(2-amidomethyl)tetrazol, L-threo-Pentonamide, 5-cyclohexyl-2,4,5-trideoxy-4-((N-(N-((1,1-dimethylethoxy)carbonyl)-L-phenylalanyl)-L-histidyl)amino)-N-(2-methyl-1-(((2H-tetrazol-2-ylmethyl)amino)carbonyl)butyl)-, (S-(R*,R*))-
Technical Specifications
| Molecular Formula | C39H59N11O7 |
| Molecular Weight | 793.4599 g/mol |
| XLogP | 4.6 |
| Topological Polar Surface Area (TPSA) | 247.0 Ų |
| Hydrogen Bond Donors | 7 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 22 |
| Exact Mass | 793.4599 Da |
| Heavy Atoms | 57 |
| Complexity | 1290.0 |
| SMILES | CCC(C)C(C(=O)NCN1N=CN=N1)NC(=O)CC(C(CC2CCCCC2)NC(=O)C(CC3=CN=CN3)NC(=O)C(CC4=CC=CC=C4)NC(=O)OC(C)(C)C)O |
| InChIKey | LXFRBEWNYDBACO-UHFFFAOYSA-N |
Chemical Property Profile of Emd 52297
Property Insights of Emd 52297
The XLogP value of 4.6 indicates that Emd 52297 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 247.0 Ų indicates high polarity, suggesting Emd 52297 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Emd 52297 has 7 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 Emd 52297?
The CAS number of Emd 52297 is 129049-51-0.
What is the molecular formula of Emd 52297?
The molecular formula of Emd 52297 is C39H59N11O7.
What is the molecular weight of Emd 52297?
The molecular weight of Emd 52297 is 793.4599 g/mol.
Where can I buy Emd 52297?
You can request a quote for Emd 52297 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Emd 52297?
Yes, CoreyChem provides custom synthesis services for Emd 52297 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.