BAS 03303612
TL;DR: BAS 03303612 (CAS 380592-75-6) is a chemical compound with molecular formula C21H21ClN2O4S and molecular weight 432.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4E)-4-[(4-chlorophenyl)-hydroxymethylidene]-1-(2-morpholin-4-ylethyl)-5-thiophen-2-ylpyrrolidine-2,3-dione
Also Known As: BAS 03303612, AB00114444-01, 4-(4-chlorobenzoyl)-3-hydroxy-1-[2-(morpholin-4-yl)ethyl]-5-(thiophen-2-yl)-2,5-dihydro-1H-pyrrol-2-one, (4E)-4-[(4-chlorophenyl)-hydroxymethylidene]-1-(2-morpholin-4-ylethyl)-5-thiophen-2-ylpyrrolidine-2,3-dione, 4-(4-chlorobenzoyl)-3-hydroxy-1-(2-morpholinoethyl)-5-(thiophen-2-yl)-1H-pyrrol-2(5H)-one
| Molecular Formula | C21H21ClN2O4S |
|---|---|
| Molecular Weight | 432.09 g/mol |
| LogP | 3.1554 |
| Topological Polar Surface Area | 70.08 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 432.09106 |
| Heavy Atoms | 29 |
| Complexity | 920.66754 |
Chemical Identifiers
| CAS Number | 380592-75-6 |
|---|---|
| SMILES | C1COCCN1CCN2C(/C(=C(/C3=CC=C(C=C3)Cl)\O)/C(=O)C2=O)C4=CC=CS4 |
Product Overview
BAS 03303612 (CAS 380592-75-6), with molecular formula C21H21ClN2O4S and molecular weight 432.09 g/mol. IUPAC: (4E)-4-[(4-chlorophenyl)-hydroxymethylidene]-1-(2-morpholin-4-ylethyl)-5-thiophen-2-ylpyrrolidine-2,3-dione.
Chemical Property Profile of BAS 03303612
Property Insights of BAS 03303612
The XLogP value of 3.1554 indicates that BAS 03303612 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 70.08 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 03303612. Following Lipinski's Rule of Five, BAS 03303612 has 1 hydrogen bond donor(s) and 6 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 03303612?
The CAS number of BAS 03303612 is 380592-75-6.
What is the molecular formula of BAS 03303612?
The molecular formula of BAS 03303612 is C21H21ClN2O4S.
What is the molecular weight of BAS 03303612?
The molecular weight of BAS 03303612 is 432.09 g/mol.
Where can I buy BAS 03303612?
You can request a quote for BAS 03303612 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 03303612?
Yes, KEHONG BIO provides custom synthesis services for BAS 03303612 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.