propyl{3-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl}carbamate
TL;DR: propyl{3-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl}carbamate (CAS 102417-01-6) is a chemical compound with molecular formula C16H26N2O4 and molecular weight 310.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
propyl N-[3-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl]carbamate
Also Known As: propyl{3-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl}carbamate, Propyl N-[3-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl]carbamate, Carbamic acid, (3-(2-hydroxy-3-((1-methylethyl)amino)propoxy)phenyl)-, propyl ester, ethyl{3-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl}carbamate, Carbamic acid, [3-[2-hydroxy-3-[(1-methylethyl)amino]propoxy]phenyl]-, propyl ester (9CI)
| Molecular Formula | C16H26N2O4 |
|---|---|
| Molecular Weight | 310.19 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 79.8 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 10 |
| Exact Mass | 310.18927 |
| Heavy Atoms | 22 |
| Complexity | 313.0 |
Chemical Identifiers
| CAS Number | 102417-01-6 |
|---|---|
| SMILES | CCCOC(=O)NC1=CC(=CC=C1)OCC(CNC(C)C)O |
| InChIKey | OHLZLQXSWNZHNC-UHFFFAOYSA-N |
Product Overview
propyl{3-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl}carbamate (CAS 102417-01-6), with molecular formula C16H26N2O4 and molecular weight 310.19 g/mol. IUPAC: propyl N-[3-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl]carbamate.
Chemical Property Profile of propyl{3-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl}carbamate
Property Insights of propyl{3-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl}carbamate
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for propyl{3-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl}carbamate. The TPSA of 79.8 Ų falls within the moderate polarity range, balancing permeability and solubility for propyl{3-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl}carbamate. Following Lipinski's Rule of Five, propyl{3-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl}carbamate 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
Frequently Asked Questions
What is the CAS number of propyl{3-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl}carbamate?
The CAS number of propyl{3-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl}carbamate is 102417-01-6.
What is the molecular formula of propyl{3-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl}carbamate?
The molecular formula of propyl{3-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl}carbamate is C16H26N2O4.
What is the molecular weight of propyl{3-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl}carbamate?
The molecular weight of propyl{3-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl}carbamate is 310.19 g/mol.
Where can I buy propyl{3-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl}carbamate?
You can request a quote for propyl{3-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl}carbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for propyl{3-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl}carbamate?
Yes, KEHONG BIO provides custom synthesis services for propyl{3-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl}carbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.