N-(2-碘-1-苯乙基)氨基甲酸甲酯
TL;DR: N-(2-碘-1-苯乙基)氨基甲酸甲酯 (CAS 22139-26-0) is a chemical compound with molecular formula C10H12INO2 and molecular weight 304.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-碘-1-苯乙基)氨基甲酸甲酯
methyl N-(2-iodo-1-phenylethyl)carbamate
Also Known As: methyl(2-iodo-1-phenylethyl)carbamate, methyl N-(2-iodo-1-phenylethyl)carbamate, Methyl-2-iod-1-phenylethan-1-carbamat, methyl (2-iodo-1-phenylethyl)carbamate, 2-[(2-Oxo-1,2-dihydro-4-pyrimidinyl)amino]benzoic acid
| Molecular Formula | C10H12INO2 |
|---|---|
| Molecular Weight | 304.99 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 38.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 304.99127 |
| Heavy Atoms | 14 |
| Complexity | 181.0 |
Chemical Identifiers
| CAS Number | 22139-26-0 |
|---|---|
| SMILES | COC(=O)NC(CI)C1=CC=CC=C1 |
| InChIKey | RPGPHTCXKBGYRX-UHFFFAOYSA-N |
Product Overview
N-(2-碘-1-苯乙基)氨基甲酸甲酯 (CAS 22139-26-0), with molecular formula C10H12INO2 and molecular weight 304.99 g/mol. IUPAC: methyl N-(2-iodo-1-phenylethyl)carbamate.
Chemical Property Profile of N-(2-碘-1-苯乙基)氨基甲酸甲酯
Property Insights of N-(2-碘-1-苯乙基)氨基甲酸甲酯
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(2-碘-1-苯乙基)氨基甲酸甲酯. With a topological polar surface area (TPSA) of 38.3 Ų, N-(2-碘-1-苯乙基)氨基甲酸甲酯 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(2-碘-1-苯乙基)氨基甲酸甲酯 has 1 hydrogen bond donor(s) and 2 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-碘-1-苯乙基)氨基甲酸甲酯?
The CAS number of N-(2-碘-1-苯乙基)氨基甲酸甲酯 is 22139-26-0.
What is the molecular formula of N-(2-碘-1-苯乙基)氨基甲酸甲酯?
The molecular formula of N-(2-碘-1-苯乙基)氨基甲酸甲酯 is C10H12INO2.
What is the molecular weight of N-(2-碘-1-苯乙基)氨基甲酸甲酯?
The molecular weight of N-(2-碘-1-苯乙基)氨基甲酸甲酯 is 304.99 g/mol.
Where can I buy N-(2-碘-1-苯乙基)氨基甲酸甲酯?
You can request a quote for N-(2-碘-1-苯乙基)氨基甲酸甲酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(2-碘-1-苯乙基)氨基甲酸甲酯?
Yes, KEHONG BIO provides custom synthesis services for N-(2-碘-1-苯乙基)氨基甲酸甲酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.