RefChem:1080905
TL;DR: RefChem:1080905 (CAS 68384-66-7) is a chemical compound with molecular formula C14H25N3O4 and molecular weight 299.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[3-(ethylcarbamoyloxymethyl)-1-methyl-2,5-dihydropyrrol-2-yl]ethyl N-ethylcarbamate
Also Known As: Synthanecine D bis-N-ethylcarbamate, 5-21-04-00377 (Beilstein Handbook Reference), 2,5-Dihydro-3-(hydroxymethyl)-1-methyl-1H-pyrrole-2-ethanol bis(ethylcarbamate), 3-Pyrroline-2-ethanol, 3-(hydroxymethyl)-1-methyl-, bis(ethylcarbamate), Carbamic acid, ethyl-, (2-(2-(((ethylamino)carbonyl)oxy)ethyl)-2,5-dihydro-1-methyl-1H-pyrrol-3-yl)methyl ester
| Molecular Formula | C14H25N3O4 |
|---|---|
| Molecular Weight | 299.18 g/mol |
| LogP | 0.4 |
| Topological Polar Surface Area | 79.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 299.1845 |
| Heavy Atoms | 21 |
| Complexity | 384.0 |
Chemical Identifiers
| CAS Number | 68384-66-7 |
|---|---|
| SMILES | CCNC(=O)OCCC1C(=CCN1C)COC(=O)NCC |
| InChIKey | NDGRGJFGBCEGFN-UHFFFAOYSA-N |
Product Overview
RefChem:1080905 (CAS 68384-66-7), with molecular formula C14H25N3O4 and molecular weight 299.18 g/mol. IUPAC: 2-[3-(ethylcarbamoyloxymethyl)-1-methyl-2,5-dihydropyrrol-2-yl]ethyl N-ethylcarbamate.
Chemical Property Profile of RefChem:1080905
Property Insights of RefChem:1080905
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:1080905. The TPSA of 79.9 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:1080905. Following Lipinski's Rule of Five, RefChem:1080905 has 2 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 RefChem:1080905?
The CAS number of RefChem:1080905 is 68384-66-7.
What is the molecular formula of RefChem:1080905?
The molecular formula of RefChem:1080905 is C14H25N3O4.
What is the molecular weight of RefChem:1080905?
The molecular weight of RefChem:1080905 is 299.18 g/mol.
Where can I buy RefChem:1080905?
You can request a quote for RefChem:1080905 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1080905?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1080905 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.