UPCMLD0ENAT5967411:001
TL;DR: UPCMLD0ENAT5967411:001 (CAS 381695-58-5) is a chemical compound with molecular formula C23H28N4O3S2 and molecular weight 472.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5Z)-3-(3-methoxypropyl)-5-[[7-methyl-2-(4-methylpiperidin-1-yl)-4-oxopyrido[1,2-a]pyrimidin-3-yl]methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
Also Known As: UPCMLD0ENAT5967411:001, (Z)-3-(3-methoxypropyl)-5-((7-methyl-2-(4-methylpiperidin-1-yl)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl)methylene)-2-thioxothiazolidin-4-one, AS-871/41371084, F1056-0206, (5Z)-3-(3-methoxypropyl)-5-{[7-methyl-2-(4-methylpiperidin-1-yl)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl]methylidene}-2-sulfanylidene-1,3-thiazolidin-4-one
| Molecular Formula | C23H28N4O3S2 |
|---|---|
| Molecular Weight | 472.16 g/mol |
| LogP | 3.47692 |
| Topological Polar Surface Area | 67.15 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 472.16028 |
| Heavy Atoms | 32 |
| Complexity | 1135.998 |
Chemical Identifiers
| CAS Number | 381695-58-5 |
|---|---|
| SMILES | CC1CCN(CC1)C2=C(C(=O)N3C=C(C=CC3=N2)C)/C=C\4/C(=O)N(C(=S)S4)CCCOC |
Product Overview
UPCMLD0ENAT5967411:001 (CAS 381695-58-5), with molecular formula C23H28N4O3S2 and molecular weight 472.16 g/mol. IUPAC: (5Z)-3-(3-methoxypropyl)-5-[[7-methyl-2-(4-methylpiperidin-1-yl)-4-oxopyrido[1,2-a]pyrimidin-3-yl]methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one.
Chemical Property Profile of UPCMLD0ENAT5967411:001
Property Insights of UPCMLD0ENAT5967411:001
The XLogP value of 3.47692 indicates that UPCMLD0ENAT5967411:001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.15 Ų falls within the moderate polarity range, balancing permeability and solubility for UPCMLD0ENAT5967411:001. Following Lipinski's Rule of Five, UPCMLD0ENAT5967411:001 has 0 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 UPCMLD0ENAT5967411:001?
The CAS number of UPCMLD0ENAT5967411:001 is 381695-58-5.
What is the molecular formula of UPCMLD0ENAT5967411:001?
The molecular formula of UPCMLD0ENAT5967411:001 is C23H28N4O3S2.
What is the molecular weight of UPCMLD0ENAT5967411:001?
The molecular weight of UPCMLD0ENAT5967411:001 is 472.16 g/mol.
Where can I buy UPCMLD0ENAT5967411:001?
You can request a quote for UPCMLD0ENAT5967411:001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for UPCMLD0ENAT5967411:001?
Yes, KEHONG BIO provides custom synthesis services for UPCMLD0ENAT5967411:001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.