Propylene diurethane
TL;DR: Propylene diurethane (CAS 818-45-1) is a chemical compound with molecular formula C9H18N2O4 and molecular weight 218.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl N-[3-(ethoxycarbonylamino)propyl]carbamate
Also Known As: PROPYLENE DIURETHANE, Diethyl Propane-1,3-Diylbiscarbamate, diethyl propane-1,3-diyldicarbamate, Ethyl N-(3-(ethoxycarbonylamino)propyl)carbamate, ethyl N-[3-(ethoxycarbonylamino)propyl]carbamate
| Molecular Formula | C9H18N2O4 |
|---|---|
| Molecular Weight | 218.13 g/mol |
| LogP | 0.8 |
| Topological Polar Surface Area | 76.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 218.12666 |
| Heavy Atoms | 15 |
| Complexity | 177.0 |
Chemical Identifiers
| CAS Number | 818-45-1 |
|---|---|
| SMILES | CCOC(=O)NCCCNC(=O)OCC |
| InChIKey | BWWHOVJFNMPUKF-UHFFFAOYSA-N |
Product Overview
Propylene diurethane (CAS 818-45-1), with molecular formula C9H18N2O4 and molecular weight 218.13 g/mol. IUPAC: ethyl N-[3-(ethoxycarbonylamino)propyl]carbamate.
Chemical Property Profile of Propylene diurethane
Property Insights of Propylene diurethane
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Propylene diurethane. The TPSA of 76.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Propylene diurethane. Following Lipinski's Rule of Five, Propylene diurethane 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 Propylene diurethane?
The CAS number of Propylene diurethane is 818-45-1.
What is the molecular formula of Propylene diurethane?
The molecular formula of Propylene diurethane is C9H18N2O4.
What is the molecular weight of Propylene diurethane?
The molecular weight of Propylene diurethane is 218.13 g/mol.
Where can I buy Propylene diurethane?
You can request a quote for Propylene diurethane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Propylene diurethane?
Yes, KEHONG BIO provides custom synthesis services for Propylene diurethane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.