PubChem SID: 24784416
TL;DR: PubChem SID: 24784416 (CAS 374541-94-3) is a chemical compound with molecular formula C17H13FN2O3S and molecular weight 344.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5E)-1-[2-(4-fluorophenyl)ethyl]-5-(thiophen-2-ylmethylidene)-1,3-diazinane-2,4,6-trione
Also Known As: PubChem SID: 24784416, BAS 13119146, (5E)-1-[2-(4-fluorophenyl)ethyl]-5-(2-thienylmethylene)hexahydropyrimidine-2,4,6-trione, (5E)-1-[2-(4-fluorophenyl)ethyl]-5-(thiophen-2-ylmethylidene)-1,3-diazinane-2,4,6-trione, (E)-1-(4-fluorophenethyl)-5-(thiophen-2-ylmethylene)pyrimidine-2,4,6(1H,3H,5H)-trione
| Molecular Formula | C17H13FN2O3S |
|---|---|
| Molecular Weight | 344.06 g/mol |
| LogP | 2.5917 |
| Topological Polar Surface Area | 66.48 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 344.06308 |
| Heavy Atoms | 24 |
| Complexity | 812.87103 |
Chemical Identifiers
| CAS Number | 374541-94-3 |
|---|---|
| SMILES | C1=CSC(=C1)/C=C/2\C(=O)NC(=O)N(C2=O)CCC3=CC=C(C=C3)F |
Product Overview
PubChem SID: 24784416 (CAS 374541-94-3), with molecular formula C17H13FN2O3S and molecular weight 344.06 g/mol. IUPAC: (5E)-1-[2-(4-fluorophenyl)ethyl]-5-(thiophen-2-ylmethylidene)-1,3-diazinane-2,4,6-trione.
Chemical Property Profile of PubChem SID: 24784416
Property Insights of PubChem SID: 24784416
The XLogP value of 2.5917 suggests moderate lipophilicity, balancing water solubility and membrane permeability for PubChem SID: 24784416. The TPSA of 66.48 Ų falls within the moderate polarity range, balancing permeability and solubility for PubChem SID: 24784416. Following Lipinski's Rule of Five, PubChem SID: 24784416 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 PubChem SID: 24784416?
The CAS number of PubChem SID: 24784416 is 374541-94-3.
What is the molecular formula of PubChem SID: 24784416?
The molecular formula of PubChem SID: 24784416 is C17H13FN2O3S.
What is the molecular weight of PubChem SID: 24784416?
The molecular weight of PubChem SID: 24784416 is 344.06 g/mol.
Where can I buy PubChem SID: 24784416?
You can request a quote for PubChem SID: 24784416 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for PubChem SID: 24784416?
Yes, KEHONG BIO provides custom synthesis services for PubChem SID: 24784416 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.