BAS 00555471
TL;DR: BAS 00555471 (CAS 307527-36-2) is a chemical compound with molecular formula C21H28N2O3S2 and molecular weight 420.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,N-diethyl-6-[(5Z)-5-[(4-methoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]hexanamide
Also Known As: BAS 00555471, N,N-diethyl-6-[(5Z)-5-(4-methoxybenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]hexanamide, (Z)-N,N-diethyl-6-(5-(4-methoxybenzylidene)-4-oxo-2-thioxothiazolidin-3-yl)hexanamide, N,N-diethyl-6-[(5Z)-5-[(4-methoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]hexanamide, N,N-diethyl-6-{5-[(4-methoxyphenyl)methylene]-4-oxo-2-thioxo(1,3-thiazolidin-3 -yl)}hexanamide
| Molecular Formula | C21H28N2O3S2 |
|---|---|
| Molecular Weight | 420.15 g/mol |
| LogP | 4.3252 |
| Topological Polar Surface Area | 49.85 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 10 |
| Exact Mass | 420.15414 |
| Heavy Atoms | 28 |
| Complexity | 727.67114 |
Chemical Identifiers
| CAS Number | 307527-36-2 |
|---|---|
| SMILES | CCN(CC)C(=O)CCCCCN1C(=O)/C(=C/C2=CC=C(C=C2)OC)/SC1=S |
Product Overview
BAS 00555471 (CAS 307527-36-2), with molecular formula C21H28N2O3S2 and molecular weight 420.15 g/mol. IUPAC: N,N-diethyl-6-[(5Z)-5-[(4-methoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]hexanamide.
Chemical Property Profile of BAS 00555471
Property Insights of BAS 00555471
The XLogP value of 4.3252 indicates that BAS 00555471 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.85 Ų, BAS 00555471 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 00555471 has 0 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 00555471?
The CAS number of BAS 00555471 is 307527-36-2.
What is the molecular formula of BAS 00555471?
The molecular formula of BAS 00555471 is C21H28N2O3S2.
What is the molecular weight of BAS 00555471?
The molecular weight of BAS 00555471 is 420.15 g/mol.
Where can I buy BAS 00555471?
You can request a quote for BAS 00555471 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00555471?
Yes, KEHONG BIO provides custom synthesis services for BAS 00555471 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.