UPCMLD0ENAT5980922:001
TL;DR: UPCMLD0ENAT5980922:001 (CAS 381697-49-0) is a chemical compound with molecular formula C24H22N4O3S2 and molecular weight 478.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5Z)-3-benzyl-5-[(7-methyl-2-morpholin-4-yl-4-oxopyrido[1,2-a]pyrimidin-3-yl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
Also Known As: UPCMLD0ENAT5980922:001, (5Z)-3-benzyl-5-[(7-methyl-2-morpholin-4-yl-4-oxopyrido[1,2-a]pyrimidin-3-yl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one, (Z)-3-benzyl-5-((7-methyl-2-morpholino-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl)methylene)-2-thioxothiazolidin-4-one, (5Z)-3-BENZYL-5-{[7-METHYL-2-(MORPHOLIN-4-YL)-4-OXO-4H-PYRIDO[1,2-A]PYRIMIDIN-3-YL]METHYLIDENE}-2-SULFANYLIDENE-1,3-THIAZOLIDIN-4-ONE, 3-[(3-benzyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-7-methyl-2-(4-morpholinyl)-4H-pyrido[1,2-a]pyrimidin-4-one
| Molecular Formula | C24H22N4O3S2 |
|---|---|
| Molecular Weight | 478.11 g/mol |
| LogP | 3.24092 |
| Topological Polar Surface Area | 67.15 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 478.11334 |
| Heavy Atoms | 33 |
| Complexity | 1330.7839 |
Chemical Identifiers
| CAS Number | 381697-49-0 |
|---|---|
| SMILES | CC1=CN2C(=NC(=C(C2=O)/C=C\3/C(=O)N(C(=S)S3)CC4=CC=CC=C4)N5CCOCC5)C=C1 |
Product Overview
UPCMLD0ENAT5980922:001 (CAS 381697-49-0), with molecular formula C24H22N4O3S2 and molecular weight 478.11 g/mol. IUPAC: (5Z)-3-benzyl-5-[(7-methyl-2-morpholin-4-yl-4-oxopyrido[1,2-a]pyrimidin-3-yl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one.
Chemical Property Profile of UPCMLD0ENAT5980922:001
Property Insights of UPCMLD0ENAT5980922:001
The XLogP value of 3.24092 indicates that UPCMLD0ENAT5980922:001 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 UPCMLD0ENAT5980922:001. Following Lipinski's Rule of Five, UPCMLD0ENAT5980922:001 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 UPCMLD0ENAT5980922:001?
The CAS number of UPCMLD0ENAT5980922:001 is 381697-49-0.
What is the molecular formula of UPCMLD0ENAT5980922:001?
The molecular formula of UPCMLD0ENAT5980922:001 is C24H22N4O3S2.
What is the molecular weight of UPCMLD0ENAT5980922:001?
The molecular weight of UPCMLD0ENAT5980922:001 is 478.11 g/mol.
Where can I buy UPCMLD0ENAT5980922:001?
You can request a quote for UPCMLD0ENAT5980922:001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for UPCMLD0ENAT5980922:001?
Yes, KEHONG BIO provides custom synthesis services for UPCMLD0ENAT5980922:001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.