UPCMLD0ENAT5967523:001
TL;DR: UPCMLD0ENAT5967523:001 (CAS 381182-95-2) is a chemical compound with molecular formula C20H18N4O3S2 and molecular weight 426.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5Z)-5-[[2-(furan-2-ylmethylamino)-4-oxopyrido[1,2-a]pyrimidin-3-yl]methylidene]-3-propyl-2-sulfanylidene-1,3-thiazolidin-4-one
Also Known As: UPCMLD0ENAT5967523:001, 2-[(2-furylmethyl)amino]-3-[(Z)-(4-oxo-3-propyl-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-4H-pyrido[1,2-a]pyrimidin-4-one, (5Z)-5-[(2-{[(FURAN-2-YL)METHYL]AMINO}-4-OXO-4H-PYRIDO[1,2-A]PYRIMIDIN-3-YL)METHYLIDENE]-3-PROPYL-2-SULFANYLIDENE-1,3-THIAZOLIDIN-4-ONE, (5Z)-5-[[2-(furan-2-ylmethylamino)-4-oxopyrido[1,2-a]pyrimidin-3-yl]methylidene]-3-propyl-2-sulfanylidene-1,3-thiazolidin-4-one, (Z)-5-((2-((furan-2-ylmethyl)amino)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl)methylene)-3-propyl-2-thioxothiazolidin-4-one
| Molecular Formula | C20H18N4O3S2 |
|---|---|
| Molecular Weight | 426.08 g/mol |
| LogP | 3.5108 |
| Topological Polar Surface Area | 79.85 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 426.08203 |
| Heavy Atoms | 29 |
| Complexity | 1168.1831 |
Chemical Identifiers
| CAS Number | 381182-95-2 |
|---|---|
| SMILES | CCCN1C(=O)/C(=C/C2=C(N=C3C=CC=CN3C2=O)NCC4=CC=CO4)/SC1=S |
Product Overview
UPCMLD0ENAT5967523:001 (CAS 381182-95-2), with molecular formula C20H18N4O3S2 and molecular weight 426.08 g/mol. IUPAC: (5Z)-5-[[2-(furan-2-ylmethylamino)-4-oxopyrido[1,2-a]pyrimidin-3-yl]methylidene]-3-propyl-2-sulfanylidene-1,3-thiazolidin-4-one.
Chemical Property Profile of UPCMLD0ENAT5967523:001
Property Insights of UPCMLD0ENAT5967523:001
The XLogP value of 3.5108 indicates that UPCMLD0ENAT5967523:001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 79.85 Ų falls within the moderate polarity range, balancing permeability and solubility for UPCMLD0ENAT5967523:001. Following Lipinski's Rule of Five, UPCMLD0ENAT5967523:001 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 UPCMLD0ENAT5967523:001?
The CAS number of UPCMLD0ENAT5967523:001 is 381182-95-2.
What is the molecular formula of UPCMLD0ENAT5967523:001?
The molecular formula of UPCMLD0ENAT5967523:001 is C20H18N4O3S2.
What is the molecular weight of UPCMLD0ENAT5967523:001?
The molecular weight of UPCMLD0ENAT5967523:001 is 426.08 g/mol.
Where can I buy UPCMLD0ENAT5967523:001?
You can request a quote for UPCMLD0ENAT5967523:001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for UPCMLD0ENAT5967523:001?
Yes, KEHONG BIO provides custom synthesis services for UPCMLD0ENAT5967523:001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.