ChemDiv3_004155
TL;DR: ChemDiv3_004155 (CAS 328068-27-5) is a chemical compound with molecular formula C11H17NO4S4 and molecular weight 355.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-methyl-1,1-dioxo-2,3-dihydrothiophen-3-yl) N-(1,1-dioxothiolan-3-yl)-N-methylcarbamodithioate
Also Known As: ChemDiv3_004155, BAS 00312640, IDI1_022065, BRD-A35756895-001-01-9, BRD-A35756895-001-08-4
| Molecular Formula | C11H17NO4S4 |
|---|---|
| Molecular Weight | 355.00 g/mol |
| LogP | 0.8242 |
| Topological Polar Surface Area | 71.52 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 355.00403 |
| Heavy Atoms | 20 |
| Complexity | 649.9106 |
Chemical Identifiers
| CAS Number | 328068-27-5 |
|---|---|
| SMILES | CC1=CS(=O)(=O)CC1SC(=S)N(C)C2CCS(=O)(=O)C2 |
Product Overview
ChemDiv3_004155 (CAS 328068-27-5), with molecular formula C11H17NO4S4 and molecular weight 355.00 g/mol. IUPAC: (4-methyl-1,1-dioxo-2,3-dihydrothiophen-3-yl) N-(1,1-dioxothiolan-3-yl)-N-methylcarbamodithioate.
Chemical Property Profile of ChemDiv3_004155
Property Insights of ChemDiv3_004155
The XLogP value of 0.8242 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ChemDiv3_004155. The TPSA of 71.52 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv3_004155. Following Lipinski's Rule of Five, ChemDiv3_004155 has 0 hydrogen bond donor(s) and 6 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 ChemDiv3_004155?
The CAS number of ChemDiv3_004155 is 328068-27-5.
What is the molecular formula of ChemDiv3_004155?
The molecular formula of ChemDiv3_004155 is C11H17NO4S4.
What is the molecular weight of ChemDiv3_004155?
The molecular weight of ChemDiv3_004155 is 355.00 g/mol.
Where can I buy ChemDiv3_004155?
You can request a quote for ChemDiv3_004155 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv3_004155?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv3_004155 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.