![N-[2-(1H-咪唑-5-基)乙基]氨基甲酸叔丁酯 structure](/static/products/186/186700-06-1.png)
N-[2-(1H-咪唑-5-基)乙基]氨基甲酸叔丁酯
TL;DR: N-[2-(1H-咪唑-5-基)乙基]氨基甲酸叔丁酯 (CAS 186700-06-1) is a chemical compound with molecular formula C10H17N3O2 and molecular weight 211.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-(1H-咪唑-5-基)乙基]氨基甲酸叔丁酯
tert-butyl N-[2-(1H-imidazol-5-yl)ethyl]carbamate
Also Known As: N-Boc Histamine, tert-Butyl (2-(1H-imidazol-5-yl)ethyl)carbamate, tert-butyl N-[2-(1H-imidazol-5-yl)ethyl]carbamate, Histamine, N-t-butyloxycarbonyl-, N-Boc-2-(4-imidazolyl)ethanamine
| Molecular Formula | C10H17N3O2 |
|---|---|
| Molecular Weight | 211.13 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 67.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 211.13208 |
| Heavy Atoms | 15 |
| Complexity | 213.0 |
Chemical Identifiers
| CAS Number | 186700-06-1 |
|---|---|
| SMILES | CC(C)(C)OC(=O)NCCC1=CN=CN1 |
| InChIKey | AZYDWKHQWJEWGN-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-[2-(1H-咪唑-5-基)乙基]氨基甲酸叔丁酯 (CAS 186700-06-1), with molecular formula C10H17N3O2 and molecular weight 211.13 g/mol. IUPAC: tert-butyl N-[2-(1H-imidazol-5-yl)ethyl]carbamate.
Chemical Property Profile of N-[2-(1H-咪唑-5-基)乙基]氨基甲酸叔丁酯
Property Insights of N-[2-(1H-咪唑-5-基)乙基]氨基甲酸叔丁酯
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[2-(1H-咪唑-5-基)乙基]氨基甲酸叔丁酯. The TPSA of 67.0 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[2-(1H-咪唑-5-基)乙基]氨基甲酸叔丁酯. Following Lipinski's Rule of Five, N-[2-(1H-咪唑-5-基)乙基]氨基甲酸叔丁酯 has 2 hydrogen bond donor(s) and 3 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 N-[2-(1H-咪唑-5-基)乙基]氨基甲酸叔丁酯?
The CAS number of N-[2-(1H-咪唑-5-基)乙基]氨基甲酸叔丁酯 is 186700-06-1.
What is the molecular formula of N-[2-(1H-咪唑-5-基)乙基]氨基甲酸叔丁酯?
The molecular formula of N-[2-(1H-咪唑-5-基)乙基]氨基甲酸叔丁酯 is C10H17N3O2.
What is the molecular weight of N-[2-(1H-咪唑-5-基)乙基]氨基甲酸叔丁酯?
The molecular weight of N-[2-(1H-咪唑-5-基)乙基]氨基甲酸叔丁酯 is 211.13 g/mol.
Where can I buy N-[2-(1H-咪唑-5-基)乙基]氨基甲酸叔丁酯?
You can request a quote for N-[2-(1H-咪唑-5-基)乙基]氨基甲酸叔丁酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[2-(1H-咪唑-5-基)乙基]氨基甲酸叔丁酯?
Yes, KEHONG BIO provides custom synthesis services for N-[2-(1H-咪唑-5-基)乙基]氨基甲酸叔丁酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.