J455.137K
TL;DR: J455.137K (CAS 102416-97-7) is a chemical compound with molecular formula C16H26N2O4 and molecular weight 310.18927 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
ethyl N-[3-[3-(tert-butylamino)-2-hydroxypropoxy]phenyl]carbamate
Also Known As: Carbamic acid, (3-(3-hydroxy-3-((1-methylethyl)amino)-2-hydroxypropoxy)phenyl)-, ethyl ester, ethyl{3-[3-(tert-butylamino)-2-hydroxypropoxy]phenyl}carbamate, Ethyl N-[3-[2-hydroxy-3-(tert-butylamino)propoxy]phenyl]carbamate, ethyl N-[3-[3-(tert-butylamino)-2-hydroxypropoxy]phenyl]carbamate, ETHYL N-{3-[3-(TERT-BUTYLAMINO)-2-HYDROXYPROPOXY]PHENYL}CARBAMATE
Technical Specifications
| Molecular Formula | C16H26N2O4 |
| Molecular Weight | 310.18927 g/mol |
| XLogP | 1.7 |
| Topological Polar Surface Area (TPSA) | 79.8 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 310.18927 Da |
| Heavy Atoms | 22 |
| Complexity | 331.0 |
| SMILES | CCOC(=O)NC1=CC(=CC=C1)OCC(CNC(C)(C)C)O |
| InChIKey | NYTHHFQMBUDRGV-UHFFFAOYSA-N |
Chemical Property Profile of J455.137K
Property Insights of J455.137K
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for J455.137K. The TPSA of 79.8 Ų falls within the moderate polarity range, balancing permeability and solubility for J455.137K. Following Lipinski's Rule of Five, J455.137K has 3 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of J455.137K?
The CAS number of J455.137K is 102416-97-7.
What is the molecular formula of J455.137K?
The molecular formula of J455.137K is C16H26N2O4.
What is the molecular weight of J455.137K?
The molecular weight of J455.137K is 310.18927 g/mol.
Where can I buy J455.137K?
You can request a quote for J455.137K directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for J455.137K?
Yes, CoreyChem provides custom synthesis services for J455.137K and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.