5-Ethyl-1-methyl-5-(propylsulfanylmethyl)-1,3-diazinane-2,4,6-trione
TL;DR: 5-Ethyl-1-methyl-5-(propylsulfanylmethyl)-1,3-diazinane-2,4,6-trione (CAS 66968-98-7) is a chemical compound with molecular formula C11H18N2O3S and molecular weight 258.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-ethyl-1-methyl-5-(propylsulfanylmethyl)-1,3-diazinane-2,4,6-trione
Also Known As: 5-ethyl-1-methyl-5-2-sodiooxy-4,6 -pyrimidinedione, 5-ethyl-1-methyl-5-(propylsulfanylmethyl)-1,3-diazinane-2,4,6-trione, 5-ethyl-1-methyl-5-[(propylsulfanyl)methyl]pyrimidine-2,4,6(1h,3h,5h)-trione
| Molecular Formula | C11H18N2O3S |
|---|---|
| Molecular Weight | 258.10 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 91.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 258.10382 |
| Heavy Atoms | 17 |
| Complexity | 346.0 |
Chemical Identifiers
| CAS Number | 66968-98-7 |
|---|---|
| SMILES | CCCSCC1(C(=O)NC(=O)N(C1=O)C)CC |
| InChIKey | YXKNPCROSWNCTJ-UHFFFAOYSA-N |
Product Overview
5-Ethyl-1-methyl-5-(propylsulfanylmethyl)-1,3-diazinane-2,4,6-trione (CAS 66968-98-7), with molecular formula C11H18N2O3S and molecular weight 258.10 g/mol. IUPAC: 5-ethyl-1-methyl-5-(propylsulfanylmethyl)-1,3-diazinane-2,4,6-trione.
Chemical Property Profile of 5-Ethyl-1-methyl-5-(propylsulfanylmethyl)-1,3-diazinane-2,4,6-trione
Property Insights of 5-Ethyl-1-methyl-5-(propylsulfanylmethyl)-1,3-diazinane-2,4,6-trione
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Ethyl-1-methyl-5-(propylsulfanylmethyl)-1,3-diazinane-2,4,6-trione. The TPSA of 91.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Ethyl-1-methyl-5-(propylsulfanylmethyl)-1,3-diazinane-2,4,6-trione. Following Lipinski's Rule of Five, 5-Ethyl-1-methyl-5-(propylsulfanylmethyl)-1,3-diazinane-2,4,6-trione has 1 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 5-Ethyl-1-methyl-5-(propylsulfanylmethyl)-1,3-diazinane-2,4,6-trione?
The CAS number of 5-Ethyl-1-methyl-5-(propylsulfanylmethyl)-1,3-diazinane-2,4,6-trione is 66968-98-7.
What is the molecular formula of 5-Ethyl-1-methyl-5-(propylsulfanylmethyl)-1,3-diazinane-2,4,6-trione?
The molecular formula of 5-Ethyl-1-methyl-5-(propylsulfanylmethyl)-1,3-diazinane-2,4,6-trione is C11H18N2O3S.
What is the molecular weight of 5-Ethyl-1-methyl-5-(propylsulfanylmethyl)-1,3-diazinane-2,4,6-trione?
The molecular weight of 5-Ethyl-1-methyl-5-(propylsulfanylmethyl)-1,3-diazinane-2,4,6-trione is 258.10 g/mol.
Where can I buy 5-Ethyl-1-methyl-5-(propylsulfanylmethyl)-1,3-diazinane-2,4,6-trione?
You can request a quote for 5-Ethyl-1-methyl-5-(propylsulfanylmethyl)-1,3-diazinane-2,4,6-trione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Ethyl-1-methyl-5-(propylsulfanylmethyl)-1,3-diazinane-2,4,6-trione?
Yes, KEHONG BIO provides custom synthesis services for 5-Ethyl-1-methyl-5-(propylsulfanylmethyl)-1,3-diazinane-2,4,6-trione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.