UPCMLD0ENAT5974719:001
TL;DR: UPCMLD0ENAT5974719:001 (CAS 380882-70-2) is a chemical compound with molecular formula C23H22N4O3S2 and molecular weight 466.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5Z)-3-benzyl-5-[[2-(3-methoxypropylamino)-4-oxopyrido[1,2-a]pyrimidin-3-yl]methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
Also Known As: UPCMLD0ENAT5974719:001, AB00117215-01, (5Z)-3-benzyl-5-[[2-(3-methoxypropylamino)-4-oxopyrido[1,2-a]pyrimidin-3-yl]methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one, (Z)-3-benzyl-5-((2-((3-methoxypropyl)amino)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl)methylene)-2-thioxothiazolidin-4-one, 3-[(Z)-(3-benzyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-2-[(3-methoxypropyl)amino]-4H-pyrido[1,2-a]pyrimidin-4-one
| Molecular Formula | C23H22N4O3S2 |
|---|---|
| Molecular Weight | 466.11 g/mol |
| LogP | 3.5443 |
| Topological Polar Surface Area | 75.94 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 466.11334 |
| Heavy Atoms | 32 |
| Complexity | 1240.9701 |
Chemical Identifiers
| CAS Number | 380882-70-2 |
|---|---|
| SMILES | COCCCNC1=C(C(=O)N2C=CC=CC2=N1)/C=C\3/C(=O)N(C(=S)S3)CC4=CC=CC=C4 |
Product Overview
UPCMLD0ENAT5974719:001 (CAS 380882-70-2), with molecular formula C23H22N4O3S2 and molecular weight 466.11 g/mol. IUPAC: (5Z)-3-benzyl-5-[[2-(3-methoxypropylamino)-4-oxopyrido[1,2-a]pyrimidin-3-yl]methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one.
Chemical Property Profile of UPCMLD0ENAT5974719:001
Property Insights of UPCMLD0ENAT5974719:001
The XLogP value of 3.5443 indicates that UPCMLD0ENAT5974719:001 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 UPCMLD0ENAT5974719:001. Following Lipinski's Rule of Five, UPCMLD0ENAT5974719:001 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 UPCMLD0ENAT5974719:001?
The CAS number of UPCMLD0ENAT5974719:001 is 380882-70-2.
What is the molecular formula of UPCMLD0ENAT5974719:001?
The molecular formula of UPCMLD0ENAT5974719:001 is C23H22N4O3S2.
What is the molecular weight of UPCMLD0ENAT5974719:001?
The molecular weight of UPCMLD0ENAT5974719:001 is 466.11 g/mol.
Where can I buy UPCMLD0ENAT5974719:001?
You can request a quote for UPCMLD0ENAT5974719:001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for UPCMLD0ENAT5974719:001?
Yes, KEHONG BIO provides custom synthesis services for UPCMLD0ENAT5974719:001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.