![5-Ethyl-5-[(2r)-Pentan-2-Yl]-2-Thioxodihydropyrimidine-4,6(1h,5h)-Dione structure](/static/products/210/21045-47-6.png)
5-Ethyl-5-[(2r)-Pentan-2-Yl]-2-Thioxodihydropyrimidine-4,6(1h,5h)-Dione
TL;DR: 5-Ethyl-5-[(2r)-Pentan-2-Yl]-2-Thioxodihydropyrimidine-4,6(1h,5h)-Dione (CAS 21045-47-6) is a chemical compound with molecular formula C11H18N2O2S and molecular weight 242.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-ethyl-5-[(2R)-pentan-2-yl]-2-sulfanylidene-1,3-diazinane-4,6-dione
Also Known As: thiopental, -Thiopentone, Thiopentobarbital, (R)-Thiopentone, (+)-Thiopental
| Molecular Formula | C11H18N2O2S |
|---|---|
| Molecular Weight | 242.11 g/mol |
| LogP | 1.3499 |
| Topological Polar Surface Area | 58.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 242.1089 |
| Heavy Atoms | 16 |
| Complexity | 307.94626 |
Chemical Identifiers
| CAS Number | 21045-47-6 |
|---|---|
| SMILES | CCC[C@@H](C)C1(C(=O)NC(=S)NC1=O)CC |
Product Overview
5-Ethyl-5-[(2r)-Pentan-2-Yl]-2-Thioxodihydropyrimidine-4,6(1h,5h)-Dione (CAS 21045-47-6), with molecular formula C11H18N2O2S and molecular weight 242.11 g/mol. IUPAC: 5-ethyl-5-[(2R)-pentan-2-yl]-2-sulfanylidene-1,3-diazinane-4,6-dione.
Chemical Property Profile of 5-Ethyl-5-[(2r)-Pentan-2-Yl]-2-Thioxodihydropyrimidine-4,6(1h,5h)-Dione
Property Insights of 5-Ethyl-5-[(2r)-Pentan-2-Yl]-2-Thioxodihydropyrimidine-4,6(1h,5h)-Dione
The XLogP value of 1.3499 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Ethyl-5-[(2r)-Pentan-2-Yl]-2-Thioxodihydropyrimidine-4,6(1h,5h)-Dione. With a topological polar surface area (TPSA) of 58.2 Ų, 5-Ethyl-5-[(2r)-Pentan-2-Yl]-2-Thioxodihydropyrimidine-4,6(1h,5h)-Dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Ethyl-5-[(2r)-Pentan-2-Yl]-2-Thioxodihydropyrimidine-4,6(1h,5h)-Dione has 2 hydrogen bond donor(s) and 3 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 5-Ethyl-5-[(2r)-Pentan-2-Yl]-2-Thioxodihydropyrimidine-4,6(1h,5h)-Dione?
The CAS number of 5-Ethyl-5-[(2r)-Pentan-2-Yl]-2-Thioxodihydropyrimidine-4,6(1h,5h)-Dione is 21045-47-6.
What is the molecular formula of 5-Ethyl-5-[(2r)-Pentan-2-Yl]-2-Thioxodihydropyrimidine-4,6(1h,5h)-Dione?
The molecular formula of 5-Ethyl-5-[(2r)-Pentan-2-Yl]-2-Thioxodihydropyrimidine-4,6(1h,5h)-Dione is C11H18N2O2S.
What is the molecular weight of 5-Ethyl-5-[(2r)-Pentan-2-Yl]-2-Thioxodihydropyrimidine-4,6(1h,5h)-Dione?
The molecular weight of 5-Ethyl-5-[(2r)-Pentan-2-Yl]-2-Thioxodihydropyrimidine-4,6(1h,5h)-Dione is 242.11 g/mol.
Where can I buy 5-Ethyl-5-[(2r)-Pentan-2-Yl]-2-Thioxodihydropyrimidine-4,6(1h,5h)-Dione?
You can request a quote for 5-Ethyl-5-[(2r)-Pentan-2-Yl]-2-Thioxodihydropyrimidine-4,6(1h,5h)-Dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Ethyl-5-[(2r)-Pentan-2-Yl]-2-Thioxodihydropyrimidine-4,6(1h,5h)-Dione?
Yes, KEHONG BIO provides custom synthesis services for 5-Ethyl-5-[(2r)-Pentan-2-Yl]-2-Thioxodihydropyrimidine-4,6(1h,5h)-Dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.