5-amino-2-(2-(((benzyloxy)carbonyl)amino)-4-(tert-butoxy)-4-oxobutanamido)-5-oxopentanoic acid
TL;DR: 5-amino-2-(2-(((benzyloxy)carbonyl)amino)-4-(tert-butoxy)-4-oxobutanamido)-5-oxopentanoic acid (CAS 1396967-13-7) is a chemical compound with molecular formula C21H29N3O8 and molecular weight 451.19547 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-amino-2-[[4-[(2-methylpropan-2-yl)oxy]-4-oxo-2-(phenylmethoxycarbonylamino)butanoyl]amino]-5-oxopentanoic acid
Also Known As: 5-amino-2-(2-(((benzyloxy)carbonyl)amino)-4-(tert-butoxy)-4-oxobutanamido)-5-oxopentanoic acid, 5-amino-2-[(2-{[(benzyloxy)carbonyl]amino}-4-tert-butoxy-4-oxobutanoyl)amino]-5-oxopentanoic acid (non-preferred name), 5-amino-2-[[4-[(2-methylpropan-2-yl)oxy]-4-oxo-2-(phenylmethoxycarbonylamino)butanoyl]amino]-5-oxopentanoic acid
Technical Specifications
| Molecular Formula | C21H29N3O8 |
| Molecular Weight | 451.19547 g/mol |
| XLogP | 0.5 |
| Topological Polar Surface Area (TPSA) | 174.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 14 |
| Exact Mass | 451.19547 Da |
| Heavy Atoms | 32 |
| Complexity | 683.0 |
| SMILES | CC(C)(C)OC(=O)CC(C(=O)NC(CCC(=O)N)C(=O)O)NC(=O)OCC1=CC=CC=C1 |
| InChIKey | AVDPHNNOSOYOHH-UHFFFAOYSA-N |
Chemical Property Profile of 5-amino-2-(2-(((benzyloxy)carbonyl)amino)-4-(tert-butoxy)-4-oxobutanamido)-5-oxopentanoic acid
Property Insights of 5-amino-2-(2-(((benzyloxy)carbonyl)amino)-4-(tert-butoxy)-4-oxobutanamido)-5-oxopentanoic acid
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-amino-2-(2-(((benzyloxy)carbonyl)amino)-4-(tert-butoxy)-4-oxobutanamido)-5-oxopentanoic acid. The TPSA of 174.0 Ų indicates high polarity, suggesting 5-amino-2-(2-(((benzyloxy)carbonyl)amino)-4-(tert-butoxy)-4-oxobutanamido)-5-oxopentanoic acid may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 5-amino-2-(2-(((benzyloxy)carbonyl)amino)-4-(tert-butoxy)-4-oxobutanamido)-5-oxopentanoic acid has 4 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 5-amino-2-(2-(((benzyloxy)carbonyl)amino)-4-(tert-butoxy)-4-oxobutanamido)-5-oxopentanoic acid?
The CAS number of 5-amino-2-(2-(((benzyloxy)carbonyl)amino)-4-(tert-butoxy)-4-oxobutanamido)-5-oxopentanoic acid is 1396967-13-7.
What is the molecular formula of 5-amino-2-(2-(((benzyloxy)carbonyl)amino)-4-(tert-butoxy)-4-oxobutanamido)-5-oxopentanoic acid?
The molecular formula of 5-amino-2-(2-(((benzyloxy)carbonyl)amino)-4-(tert-butoxy)-4-oxobutanamido)-5-oxopentanoic acid is C21H29N3O8.
What is the molecular weight of 5-amino-2-(2-(((benzyloxy)carbonyl)amino)-4-(tert-butoxy)-4-oxobutanamido)-5-oxopentanoic acid?
The molecular weight of 5-amino-2-(2-(((benzyloxy)carbonyl)amino)-4-(tert-butoxy)-4-oxobutanamido)-5-oxopentanoic acid is 451.19547 g/mol.
Where can I buy 5-amino-2-(2-(((benzyloxy)carbonyl)amino)-4-(tert-butoxy)-4-oxobutanamido)-5-oxopentanoic acid?
You can request a quote for 5-amino-2-(2-(((benzyloxy)carbonyl)amino)-4-(tert-butoxy)-4-oxobutanamido)-5-oxopentanoic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 5-amino-2-(2-(((benzyloxy)carbonyl)amino)-4-(tert-butoxy)-4-oxobutanamido)-5-oxopentanoic acid?
Yes, CoreyChem provides custom synthesis services for 5-amino-2-(2-(((benzyloxy)carbonyl)amino)-4-(tert-butoxy)-4-oxobutanamido)-5-oxopentanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.