BAS 00502744
TL;DR: BAS 00502744 (CAS 303101-72-6) is a chemical compound with molecular formula C25H30N2O3S2 and molecular weight 470.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1-adamantyl)-4-[(5Z)-5-[(4-methoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]butanamide
Also Known As: BAS 00502744, BIM-0023433.P001, BRD-K97007853-001-02-8, F0385-0444, N-1-adamantyl-4-[5-(4-methoxybenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]butanamide
| Molecular Formula | C25H30N2O3S2 |
|---|---|
| Molecular Weight | 470.17 g/mol |
| LogP | 4.7616 |
| Topological Polar Surface Area | 58.64 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 470.1698 |
| Heavy Atoms | 32 |
| Complexity | 921.1544 |
Chemical Identifiers
| CAS Number | 303101-72-6 |
|---|---|
| SMILES | COC1=CC=C(C=C1)/C=C\2/C(=O)N(C(=S)S2)CCCC(=O)NC34CC5CC(C3)CC(C5)C4 |
Product Overview
BAS 00502744 (CAS 303101-72-6), with molecular formula C25H30N2O3S2 and molecular weight 470.17 g/mol. IUPAC: N-(1-adamantyl)-4-[(5Z)-5-[(4-methoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]butanamide.
Chemical Property Profile of BAS 00502744
Property Insights of BAS 00502744
The XLogP value of 4.7616 indicates that BAS 00502744 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.64 Ų, BAS 00502744 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 00502744 has 1 hydrogen bond donor(s) and 5 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 BAS 00502744?
The CAS number of BAS 00502744 is 303101-72-6.
What is the molecular formula of BAS 00502744?
The molecular formula of BAS 00502744 is C25H30N2O3S2.
What is the molecular weight of BAS 00502744?
The molecular weight of BAS 00502744 is 470.17 g/mol.
Where can I buy BAS 00502744?
You can request a quote for BAS 00502744 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00502744?
Yes, KEHONG BIO provides custom synthesis services for BAS 00502744 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.