ChemDiv2_003934
TL;DR: ChemDiv2_003934 (CAS 371205-90-2) is a chemical compound with molecular formula C18H12FN3O3S2 and molecular weight 401.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-fluorophenyl)-4-hydroxy-1-(5-methyl-1,3,4-thiadiazol-2-yl)-3-(thiophene-2-carbonyl)-2H-pyrrol-5-one
Also Known As: ChemDiv2_003934, IDI1_002649, BAS 03305191, AB00118782-01, (4E)-5-(2-fluorophenyl)-4-[hydroxy(thiophen-2-yl)methylidene]-1-(5-methyl-1,3,4-thiadiazol-2-yl)pyrrolidine-2,3-dione
| Molecular Formula | C18H12FN3O3S2 |
|---|---|
| Molecular Weight | 401.03 g/mol |
| LogP | 3.83002 |
| Topological Polar Surface Area | 83.39 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 401.03043 |
| Heavy Atoms | 27 |
| Complexity | 1075.2296 |
Chemical Identifiers
| CAS Number | 371205-90-2 |
|---|---|
| SMILES | CC1=NN=C(S1)N2C(C(=C(C2=O)O)C(=O)C3=CC=CS3)C4=CC=CC=C4F |
Product Overview
ChemDiv2_003934 (CAS 371205-90-2), with molecular formula C18H12FN3O3S2 and molecular weight 401.03 g/mol. IUPAC: 2-(2-fluorophenyl)-4-hydroxy-1-(5-methyl-1,3,4-thiadiazol-2-yl)-3-(thiophene-2-carbonyl)-2H-pyrrol-5-one.
Chemical Property Profile of ChemDiv2_003934
Property Insights of ChemDiv2_003934
The XLogP value of 3.83002 indicates that ChemDiv2_003934 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 83.39 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv2_003934. Following Lipinski's Rule of Five, ChemDiv2_003934 has 1 hydrogen bond donor(s) and 7 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 ChemDiv2_003934?
The CAS number of ChemDiv2_003934 is 371205-90-2.
What is the molecular formula of ChemDiv2_003934?
The molecular formula of ChemDiv2_003934 is C18H12FN3O3S2.
What is the molecular weight of ChemDiv2_003934?
The molecular weight of ChemDiv2_003934 is 401.03 g/mol.
Where can I buy ChemDiv2_003934?
You can request a quote for ChemDiv2_003934 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv2_003934?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv2_003934 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.