BAS 01028957
TL;DR: BAS 01028957 (CAS 329689-20-5) is a chemical compound with molecular formula C17H23N3O5S and molecular weight 381.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-hydroxy-3-methoxy-5-nitrophenyl)-3-(2-piperidin-1-ylethyl)-1,3-thiazolidin-4-one
Also Known As: BAS 01028957, 2-(4-hydroxy-3-methoxy-5-nitrophenyl)-3-(2-piperidin-1-ylethyl)-1,3-thiazolidin-4-one, 2-(4-hydroxy-3-methoxy-5-nitrophenyl)-3-[2-(piperidin-1-yl)ethyl]-1,3-thiazolidin-4-one, 2-[4-hydroxy-3-nitro-5-(methyloxy)phenyl]-3-(2-piperidin-1-ylethyl)-1,3-thiazolidin-4-one
| Molecular Formula | C17H23N3O5S |
|---|---|
| Molecular Weight | 381.14 g/mol |
| LogP | 2.3689 |
| Topological Polar Surface Area | 96.15 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 381.13583 |
| Heavy Atoms | 26 |
| Complexity | 693.22107 |
Chemical Identifiers
| CAS Number | 329689-20-5 |
|---|---|
| SMILES | COC1=CC(=CC(=C1O)[N+](=O)[O-])C2N(C(=O)CS2)CCN3CCCCC3 |
Product Overview
BAS 01028957 (CAS 329689-20-5), with molecular formula C17H23N3O5S and molecular weight 381.14 g/mol. IUPAC: 2-(4-hydroxy-3-methoxy-5-nitrophenyl)-3-(2-piperidin-1-ylethyl)-1,3-thiazolidin-4-one.
Chemical Property Profile of BAS 01028957
Property Insights of BAS 01028957
The XLogP value of 2.3689 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 01028957. The TPSA of 96.15 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 01028957. Following Lipinski's Rule of Five, BAS 01028957 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 BAS 01028957?
The CAS number of BAS 01028957 is 329689-20-5.
What is the molecular formula of BAS 01028957?
The molecular formula of BAS 01028957 is C17H23N3O5S.
What is the molecular weight of BAS 01028957?
The molecular weight of BAS 01028957 is 381.14 g/mol.
Where can I buy BAS 01028957?
You can request a quote for BAS 01028957 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01028957?
Yes, KEHONG BIO provides custom synthesis services for BAS 01028957 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.