(S)-Methyl 2-((tert-butoxycarbonyl)amino)pent-4-enoate
TL;DR: (S)-Methyl 2-((tert-butoxycarbonyl)amino)pent-4-enoate (CAS 89985-90-0) is a chemical compound with molecular formula C11H19NO4 and molecular weight 229.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]pent-4-enoate
Also Known As: (S)-Methyl 2-((tert-butoxycarbonyl)amino)pent-4-enoate, L-Methyl-Boc-Allylglycine, ACN-S005321, 4948AC, (2S)-2-(Boc-amino)-4-pentenoic acid methyl ester
| Molecular Formula | C11H19NO4 |
|---|---|
| Molecular Weight | 229.13 g/mol |
| LogP | 1.6288 |
| Topological Polar Surface Area | 64.63 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 229.13141 |
| Heavy Atoms | 16 |
| Complexity | 267.64835 |
Chemical Identifiers
| CAS Number | 89985-90-0 |
|---|---|
| SMILES | CC(C)(C)OC(=O)N[C@@H](CC=C)C(=O)OC |
Product Overview
(S)-Methyl 2-((tert-butoxycarbonyl)amino)pent-4-enoate (CAS 89985-90-0), with molecular formula C11H19NO4 and molecular weight 229.13 g/mol. IUPAC: methyl (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]pent-4-enoate.
Chemical Property Profile of (S)-Methyl 2-((tert-butoxycarbonyl)amino)pent-4-enoate
Property Insights of (S)-Methyl 2-((tert-butoxycarbonyl)amino)pent-4-enoate
The XLogP value of 1.6288 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (S)-Methyl 2-((tert-butoxycarbonyl)amino)pent-4-enoate. The TPSA of 64.63 Ų falls within the moderate polarity range, balancing permeability and solubility for (S)-Methyl 2-((tert-butoxycarbonyl)amino)pent-4-enoate. Following Lipinski's Rule of Five, (S)-Methyl 2-((tert-butoxycarbonyl)amino)pent-4-enoate has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (S)-Methyl 2-((tert-butoxycarbonyl)amino)pent-4-enoate?
The CAS number of (S)-Methyl 2-((tert-butoxycarbonyl)amino)pent-4-enoate is 89985-90-0.
What is the molecular formula of (S)-Methyl 2-((tert-butoxycarbonyl)amino)pent-4-enoate?
The molecular formula of (S)-Methyl 2-((tert-butoxycarbonyl)amino)pent-4-enoate is C11H19NO4.
What is the molecular weight of (S)-Methyl 2-((tert-butoxycarbonyl)amino)pent-4-enoate?
The molecular weight of (S)-Methyl 2-((tert-butoxycarbonyl)amino)pent-4-enoate is 229.13 g/mol.
Where can I buy (S)-Methyl 2-((tert-butoxycarbonyl)amino)pent-4-enoate?
You can request a quote for (S)-Methyl 2-((tert-butoxycarbonyl)amino)pent-4-enoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (S)-Methyl 2-((tert-butoxycarbonyl)amino)pent-4-enoate?
Yes, KEHONG BIO provides custom synthesis services for (S)-Methyl 2-((tert-butoxycarbonyl)amino)pent-4-enoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.