3-(对丁氧基苄基)卡巴肼酸乙酯
TL;DR: 3-(对丁氧基苄基)卡巴肼酸乙酯 (CAS 69353-12-4) is a chemical compound with molecular formula C14H22N2O3 and molecular weight 266.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(对丁氧基苄基)卡巴肼酸乙酯
ethyl N-[(4-butoxyphenyl)methylamino]carbamate
Also Known As: 3- carbazicacidethylester, Ethyl (3-(p-butoxy)benzyl)carbazate, CARBAZIC ACID, 3-(p-BUTOXYBENZYL)-, ETHYL ESTER, Carbamic acid, (p-butoxybenzylamino)-, ethyl ester, ethyl N-[(4-butoxyphenyl)methylamino]carbamate
| Molecular Formula | C14H22N2O3 |
|---|---|
| Molecular Weight | 266.16 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 59.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 9 |
| Exact Mass | 266.16306 |
| Heavy Atoms | 19 |
| Complexity | 241.0 |
Chemical Identifiers
| CAS Number | 69353-12-4 |
|---|---|
| SMILES | CCCCOC1=CC=C(C=C1)CNNC(=O)OCC |
| InChIKey | WQYJZIAJVVJGRD-UHFFFAOYSA-N |
Product Overview
3-(对丁氧基苄基)卡巴肼酸乙酯 (CAS 69353-12-4), with molecular formula C14H22N2O3 and molecular weight 266.16 g/mol. IUPAC: ethyl N-[(4-butoxyphenyl)methylamino]carbamate.
Chemical Property Profile of 3-(对丁氧基苄基)卡巴肼酸乙酯
Property Insights of 3-(对丁氧基苄基)卡巴肼酸乙酯
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(对丁氧基苄基)卡巴肼酸乙酯. With a topological polar surface area (TPSA) of 59.6 Ų, 3-(对丁氧基苄基)卡巴肼酸乙酯 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(对丁氧基苄基)卡巴肼酸乙酯 has 2 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 3-(对丁氧基苄基)卡巴肼酸乙酯?
The CAS number of 3-(对丁氧基苄基)卡巴肼酸乙酯 is 69353-12-4.
What is the molecular formula of 3-(对丁氧基苄基)卡巴肼酸乙酯?
The molecular formula of 3-(对丁氧基苄基)卡巴肼酸乙酯 is C14H22N2O3.
What is the molecular weight of 3-(对丁氧基苄基)卡巴肼酸乙酯?
The molecular weight of 3-(对丁氧基苄基)卡巴肼酸乙酯 is 266.16 g/mol.
Where can I buy 3-(对丁氧基苄基)卡巴肼酸乙酯?
You can request a quote for 3-(对丁氧基苄基)卡巴肼酸乙酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(对丁氧基苄基)卡巴肼酸乙酯?
Yes, KEHONG BIO provides custom synthesis services for 3-(对丁氧基苄基)卡巴肼酸乙酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.