UPCMLD0ENAT5927199:001
TL;DR: UPCMLD0ENAT5927199:001 (CAS 727358-86-3) is a chemical compound with molecular formula C20H16N4O3S and molecular weight 392.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3-dimethyl-5-[(1-phenyl-3-thiophen-2-ylpyrazol-4-yl)methylidene]-1,3-diazinane-2,4,6-trione
Also Known As: UPCMLD0ENAT5927199:001, F3324-0224, 1,3-dimethyl-5-{[1-phenyl-3-(2-thienyl)-1H-pyrazol-4-yl]methylene}-2,4,6(1H,3H,5H)-pyrimidinetrione, 1,3-dimethyl-5-((1-phenyl-3-(thiophen-2-yl)-1H-pyrazol-4-yl)methylene)pyrimidine-2,4,6(1H,3H,5H)-trione, 1,3-dimethyl-5-[(1-phenyl-3-thiophen-2-ylpyrazol-4-yl)methylidene]-1,3-diazinane-2,4,6-trione
| Molecular Formula | C20H16N4O3S |
|---|---|
| Molecular Weight | 392.09 g/mol |
| LogP | 3.0346 |
| Topological Polar Surface Area | 75.51 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 392.0943 |
| Heavy Atoms | 28 |
| Complexity | 1073.9415 |
Chemical Identifiers
| CAS Number | 727358-86-3 |
|---|---|
| SMILES | CN1C(=O)C(=CC2=CN(N=C2C3=CC=CS3)C4=CC=CC=C4)C(=O)N(C1=O)C |
Product Overview
UPCMLD0ENAT5927199:001 (CAS 727358-86-3), with molecular formula C20H16N4O3S and molecular weight 392.09 g/mol. IUPAC: 1,3-dimethyl-5-[(1-phenyl-3-thiophen-2-ylpyrazol-4-yl)methylidene]-1,3-diazinane-2,4,6-trione.
Chemical Property Profile of UPCMLD0ENAT5927199:001
Property Insights of UPCMLD0ENAT5927199:001
The XLogP value of 3.0346 indicates that UPCMLD0ENAT5927199:001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 75.51 Ų falls within the moderate polarity range, balancing permeability and solubility for UPCMLD0ENAT5927199:001. Following Lipinski's Rule of Five, UPCMLD0ENAT5927199:001 has 0 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 UPCMLD0ENAT5927199:001?
The CAS number of UPCMLD0ENAT5927199:001 is 727358-86-3.
What is the molecular formula of UPCMLD0ENAT5927199:001?
The molecular formula of UPCMLD0ENAT5927199:001 is C20H16N4O3S.
What is the molecular weight of UPCMLD0ENAT5927199:001?
The molecular weight of UPCMLD0ENAT5927199:001 is 392.09 g/mol.
Where can I buy UPCMLD0ENAT5927199:001?
You can request a quote for UPCMLD0ENAT5927199:001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for UPCMLD0ENAT5927199:001?
Yes, KEHONG BIO provides custom synthesis services for UPCMLD0ENAT5927199:001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.