1-Propyl-2-sulfanylidene-1,3-diazinane-4,6-dione
TL;DR: 1-Propyl-2-sulfanylidene-1,3-diazinane-4,6-dione (CAS 31785-05-4) is a chemical compound with molecular formula C7H10N2O2S and molecular weight 186.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-propyl-2-sulfanylidene-1,3-diazinane-4,6-dione
Also Known As: 1-propyl-2-sulfanylidene-1,3-diazinane-4,6-dione, 1-Propyl-2-thioxodihydropyrimidine-4,6(1H,5H)-dione, 1-Propyl-2-thioxo-dihydro-pyrimidine-4,6-dione, 1-propyl-2-thioxo-hexahydropyrimidine-4,6-dione, ETHYL 5-AMINO-2-METHYLTHIAZOLE-4-CARBOXYLATE
| Molecular Formula | C7H10N2O2S |
|---|---|
| Molecular Weight | 186.05 g/mol |
| LogP | 0.0298 |
| Topological Polar Surface Area | 49.41 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 186.0463 |
| Heavy Atoms | 12 |
| Complexity | 219.56088 |
Chemical Identifiers
| CAS Number | 31785-05-4 |
|---|---|
| SMILES | CCCN1C(=O)CC(=O)NC1=S |
Product Overview
1-Propyl-2-sulfanylidene-1,3-diazinane-4,6-dione (CAS 31785-05-4), with molecular formula C7H10N2O2S and molecular weight 186.05 g/mol. IUPAC: 1-propyl-2-sulfanylidene-1,3-diazinane-4,6-dione.
Chemical Property Profile of 1-Propyl-2-sulfanylidene-1,3-diazinane-4,6-dione
Property Insights of 1-Propyl-2-sulfanylidene-1,3-diazinane-4,6-dione
The XLogP value of 0.0298 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Propyl-2-sulfanylidene-1,3-diazinane-4,6-dione. With a topological polar surface area (TPSA) of 49.41 Ų, 1-Propyl-2-sulfanylidene-1,3-diazinane-4,6-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Propyl-2-sulfanylidene-1,3-diazinane-4,6-dione has 1 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 1-Propyl-2-sulfanylidene-1,3-diazinane-4,6-dione?
The CAS number of 1-Propyl-2-sulfanylidene-1,3-diazinane-4,6-dione is 31785-05-4.
What is the molecular formula of 1-Propyl-2-sulfanylidene-1,3-diazinane-4,6-dione?
The molecular formula of 1-Propyl-2-sulfanylidene-1,3-diazinane-4,6-dione is C7H10N2O2S.
What is the molecular weight of 1-Propyl-2-sulfanylidene-1,3-diazinane-4,6-dione?
The molecular weight of 1-Propyl-2-sulfanylidene-1,3-diazinane-4,6-dione is 186.05 g/mol.
Where can I buy 1-Propyl-2-sulfanylidene-1,3-diazinane-4,6-dione?
You can request a quote for 1-Propyl-2-sulfanylidene-1,3-diazinane-4,6-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Propyl-2-sulfanylidene-1,3-diazinane-4,6-dione?
Yes, KEHONG BIO provides custom synthesis services for 1-Propyl-2-sulfanylidene-1,3-diazinane-4,6-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.