pentyl{4-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl}carbamate
TL;DR: pentyl{4-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl}carbamate (CAS 77358-96-4) is a chemical compound with molecular formula C18H30N2O4 and molecular weight 338.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
pentyl N-[4-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl]carbamate
Also Known As: pentyl{4-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl}carbamate, Pentyl N-[4-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl]carbamate, Carbamic acid, (4-(2-hydroxy-3-((1-methylethyl)amino)propoxy)phenyl)-, pentyl ester, [4-(2-Hydroxy-3-isopropylamino-propoxy)-phenyl]-carbamic acid pentyl ester, [4-[2-Hydroxy-3-(isopropylamino)propoxy]phenyl]carbamic acid pentyl ester
| Molecular Formula | C18H30N2O4 |
|---|---|
| Molecular Weight | 338.22 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 79.8 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 12 |
| Exact Mass | 338.22055 |
| Heavy Atoms | 24 |
| Complexity | 331.0 |
Chemical Identifiers
| CAS Number | 77358-96-4 |
|---|---|
| SMILES | CCCCCOC(=O)NC1=CC=C(C=C1)OCC(CNC(C)C)O |
| InChIKey | QJILICAJEUQZNA-UHFFFAOYSA-N |
Product Overview
pentyl{4-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl}carbamate (CAS 77358-96-4), with molecular formula C18H30N2O4 and molecular weight 338.22 g/mol. IUPAC: pentyl N-[4-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl]carbamate.
Chemical Property Profile of pentyl{4-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl}carbamate
Property Insights of pentyl{4-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl}carbamate
The XLogP value of 3.0 indicates that pentyl{4-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl}carbamate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 79.8 Ų falls within the moderate polarity range, balancing permeability and solubility for pentyl{4-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl}carbamate. Following Lipinski's Rule of Five, pentyl{4-[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 pentyl{4-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl}carbamate?
The CAS number of pentyl{4-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl}carbamate is 77358-96-4.
What is the molecular formula of pentyl{4-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl}carbamate?
The molecular formula of pentyl{4-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl}carbamate is C18H30N2O4.
What is the molecular weight of pentyl{4-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl}carbamate?
The molecular weight of pentyl{4-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl}carbamate is 338.22 g/mol.
Where can I buy pentyl{4-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl}carbamate?
You can request a quote for pentyl{4-[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 pentyl{4-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl}carbamate?
Yes, KEHONG BIO provides custom synthesis services for pentyl{4-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl}carbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.