Butyl N-[3-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl]carbamate
TL;DR: Butyl N-[3-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl]carbamate (CAS 102417-13-0) is a chemical compound with molecular formula C17H28N2O4 and molecular weight 324.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
butyl N-[3-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl]carbamate
Also Known As: Butyl N-[3-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl]carbamate, Carbamic acid, (3-(2-hydroxy-3-((1-methylethyl)amino)propoxy)phenyl)-, butyl ester, butyl N-[3-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl]car, butyl{3-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl}carbamate, Carbamic acid,[3-[2-hydroxy-3-[(1-methylethyl)amino]propoxy]phenyl]-, butyl ester (9CI)
| Molecular Formula | C17H28N2O4 |
|---|---|
| Molecular Weight | 324.20 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 79.8 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 11 |
| Exact Mass | 324.2049 |
| Heavy Atoms | 23 |
| Complexity | 326.0 |
Chemical Identifiers
| CAS Number | 102417-13-0 |
|---|---|
| SMILES | CCCCOC(=O)NC1=CC(=CC=C1)OCC(CNC(C)C)O |
| InChIKey | CWPHIFINLABJJM-UHFFFAOYSA-N |
Product Overview
Butyl N-[3-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl]carbamate (CAS 102417-13-0), with molecular formula C17H28N2O4 and molecular weight 324.20 g/mol. IUPAC: butyl N-[3-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl]carbamate.
Chemical Property Profile of Butyl N-[3-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl]carbamate
Property Insights of Butyl N-[3-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl]carbamate
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Butyl N-[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 Butyl N-[3-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl]carbamate. Following Lipinski's Rule of Five, Butyl N-[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 Butyl N-[3-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl]carbamate?
The CAS number of Butyl N-[3-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl]carbamate is 102417-13-0.
What is the molecular formula of Butyl N-[3-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl]carbamate?
The molecular formula of Butyl N-[3-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl]carbamate is C17H28N2O4.
What is the molecular weight of Butyl N-[3-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl]carbamate?
The molecular weight of Butyl N-[3-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl]carbamate is 324.20 g/mol.
Where can I buy Butyl N-[3-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl]carbamate?
You can request a quote for Butyl N-[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 Butyl N-[3-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl]carbamate?
Yes, KEHONG BIO provides custom synthesis services for Butyl N-[3-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl]carbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.