UPCMLD0ENAT5980944:001
TL;DR: UPCMLD0ENAT5980944:001 (CAS 372501-39-8) is a chemical compound with molecular formula C25H24N4O3S2 and molecular weight 492.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5Z)-5-[[4-oxo-2-(oxolan-2-ylmethylamino)pyrido[1,2-a]pyrimidin-3-yl]methylidene]-3-(1-phenylethyl)-2-sulfanylidene-1,3-thiazolidin-4-one
Also Known As: UPCMLD0ENAT5980944:001, 3-{(Z)-[4-oxo-3-(1-phenylethyl)-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-2-[(tetrahydrofuran-2-ylmethyl)amino]-4H-pyrido[1,2-a]pyrimidin-4-one, (5Z)-5-[[4-oxo-2-(oxolan-2-ylmethylamino)pyrido[1,2-a]pyrimidin-3-yl]methylidene]-3-(1-phenylethyl)-2-sulfanylidene-1,3-thiazolidin-4-one, (Z)-5-((4-oxo-2-(((tetrahydrofuran-2-yl)methyl)amino)-4H-pyrido[1,2-a]pyrimidin-3-yl)methylene)-3-(1-phenylethyl)-2-thioxothiazolidin-4-one
| Molecular Formula | C25H24N4O3S2 |
|---|---|
| Molecular Weight | 492.13 g/mol |
| LogP | 4.2478 |
| Topological Polar Surface Area | 75.94 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 492.129 |
| Heavy Atoms | 34 |
| Complexity | 1332.9902 |
Chemical Identifiers
| CAS Number | 372501-39-8 |
|---|---|
| SMILES | CC(C1=CC=CC=C1)N2C(=O)/C(=C/C3=C(N=C4C=CC=CN4C3=O)NCC5CCCO5)/SC2=S |
Product Overview
UPCMLD0ENAT5980944:001 (CAS 372501-39-8), with molecular formula C25H24N4O3S2 and molecular weight 492.13 g/mol. IUPAC: (5Z)-5-[[4-oxo-2-(oxolan-2-ylmethylamino)pyrido[1,2-a]pyrimidin-3-yl]methylidene]-3-(1-phenylethyl)-2-sulfanylidene-1,3-thiazolidin-4-one.
Chemical Property Profile of UPCMLD0ENAT5980944:001
Property Insights of UPCMLD0ENAT5980944:001
The XLogP value of 4.2478 indicates that UPCMLD0ENAT5980944:001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 75.94 Ų falls within the moderate polarity range, balancing permeability and solubility for UPCMLD0ENAT5980944:001. Following Lipinski's Rule of Five, UPCMLD0ENAT5980944:001 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 UPCMLD0ENAT5980944:001?
The CAS number of UPCMLD0ENAT5980944:001 is 372501-39-8.
What is the molecular formula of UPCMLD0ENAT5980944:001?
The molecular formula of UPCMLD0ENAT5980944:001 is C25H24N4O3S2.
What is the molecular weight of UPCMLD0ENAT5980944:001?
The molecular weight of UPCMLD0ENAT5980944:001 is 492.13 g/mol.
Where can I buy UPCMLD0ENAT5980944:001?
You can request a quote for UPCMLD0ENAT5980944:001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for UPCMLD0ENAT5980944:001?
Yes, KEHONG BIO provides custom synthesis services for UPCMLD0ENAT5980944:001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.