AB00117535-01
TL;DR: AB00117535-01 (CAS 378756-96-8) is a chemical compound with molecular formula C16H16N4O3S2 and molecular weight 376.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5Z)-5-[[2-(2-methoxyethylamino)-4-oxopyrido[1,2-a]pyrimidin-3-yl]methylidene]-3-methyl-2-sulfanylidene-1,3-thiazolidin-4-one
Also Known As: AB00117535-01, 2-[(2-methoxyethyl)amino]-3-[(Z)-(3-methyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-4H-pyrido[1,2-a]pyrimidin-4-one, (5Z)-5-[[2-(2-methoxyethylamino)-4-oxopyrido[1,2-a]pyrimidin-3-yl]methylidene]-3-methyl-2-sulfanylidene-1,3-thiazolidin-4-one, (5Z)-5-({2-[(2-METHOXYETHYL)AMINO]-4-OXO-4H-PYRIDO[1,2-A]PYRIMIDIN-3-YL}METHYLIDENE)-3-METHYL-2-SULFANYLIDENE-1,3-THIAZOLIDIN-4-ONE, (Z)-5-((2-((2-methoxyethyl)amino)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl)methylene)-3-methyl-2-thioxothiazolidin-4-one
| Molecular Formula | C16H16N4O3S2 |
|---|---|
| Molecular Weight | 376.07 g/mol |
| LogP | 1.5838 |
| Topological Polar Surface Area | 75.94 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 376.06638 |
| Heavy Atoms | 25 |
| Complexity | 938.612 |
Chemical Identifiers
| CAS Number | 378756-96-8 |
|---|---|
| SMILES | CN1C(=O)/C(=C/C2=C(N=C3C=CC=CN3C2=O)NCCOC)/SC1=S |
Product Overview
AB00117535-01 (CAS 378756-96-8), with molecular formula C16H16N4O3S2 and molecular weight 376.07 g/mol. IUPAC: (5Z)-5-[[2-(2-methoxyethylamino)-4-oxopyrido[1,2-a]pyrimidin-3-yl]methylidene]-3-methyl-2-sulfanylidene-1,3-thiazolidin-4-one.
Chemical Property Profile of AB00117535-01
Property Insights of AB00117535-01
The XLogP value of 1.5838 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AB00117535-01. The TPSA of 75.94 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00117535-01. Following Lipinski's Rule of Five, AB00117535-01 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 AB00117535-01?
The CAS number of AB00117535-01 is 378756-96-8.
What is the molecular formula of AB00117535-01?
The molecular formula of AB00117535-01 is C16H16N4O3S2.
What is the molecular weight of AB00117535-01?
The molecular weight of AB00117535-01 is 376.07 g/mol.
Where can I buy AB00117535-01?
You can request a quote for AB00117535-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00117535-01?
Yes, KEHONG BIO provides custom synthesis services for AB00117535-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.