ChemDiv3_007198
TL;DR: ChemDiv3_007198 (CAS 5766-39-2) is a chemical compound with molecular formula C19H19N3O3S and molecular weight 369.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2,5-dioxopyrrolidin-3-yl) N'-[(4-methoxyphenyl)methyl]-N-phenylcarbamimidothioate
Also Known As: ChemDiv3_007198, IDI1_025108, BAS 01157414, (2,5-dioxopyrrolidin-3-yl) N'-[(4-methoxyphenyl)methyl]-N-phenylcarbamimidothioate, BRD-A05907206-001-01-8
| Molecular Formula | C19H19N3O3S |
|---|---|
| Molecular Weight | 369.11 g/mol |
| LogP | 2.8116 |
| Topological Polar Surface Area | 79.79 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 369.11472 |
| Heavy Atoms | 26 |
| Complexity | 806.5389 |
Chemical Identifiers
| CAS Number | 5766-39-2 |
|---|---|
| SMILES | COC1=CC=C(C=C1)CN=C(NC2=CC=CC=C2)SC3CC(=O)NC3=O |
Product Overview
ChemDiv3_007198 (CAS 5766-39-2), with molecular formula C19H19N3O3S and molecular weight 369.11 g/mol. IUPAC: (2,5-dioxopyrrolidin-3-yl) N'-[(4-methoxyphenyl)methyl]-N-phenylcarbamimidothioate.
Chemical Property Profile of ChemDiv3_007198
Property Insights of ChemDiv3_007198
The XLogP value of 2.8116 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ChemDiv3_007198. The TPSA of 79.79 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv3_007198. Following Lipinski's Rule of Five, ChemDiv3_007198 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 ChemDiv3_007198?
The CAS number of ChemDiv3_007198 is 5766-39-2.
What is the molecular formula of ChemDiv3_007198?
The molecular formula of ChemDiv3_007198 is C19H19N3O3S.
What is the molecular weight of ChemDiv3_007198?
The molecular weight of ChemDiv3_007198 is 369.11 g/mol.
Where can I buy ChemDiv3_007198?
You can request a quote for ChemDiv3_007198 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv3_007198?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv3_007198 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.