BAS 00727823
TL;DR: BAS 00727823 (CAS 312631-89-3) is a chemical compound with molecular formula C27H23Cl2N3O3S and molecular weight 539.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5E)-3-[3-(3,6-dichlorocarbazol-9-yl)-2-hydroxypropyl]-5-[[4-(dimethylamino)phenyl]methylidene]-1,3-thiazolidine-2,4-dione
Also Known As: BAS 00727823, (5E)-3-[3-(3,6-dichloro-9H-carbazol-9-yl)-2-hydroxypropyl]-5-[4-(dimethylamino)benzylidene]-1,3-thiazolidine-2,4-dione, (5E)-3-[3-(3,6-DICHLORO-9H-CARBAZOL-9-YL)-2-HYDROXYPROPYL]-5-{[4-(DIMETHYLAMINO)PHENYL]METHYLIDENE}-1,3-THIAZOLIDINE-2,4-DIONE, (5E)-3-[3-(3,6-dichlorocarbazol-9-yl)-2-hydroxypropyl]-5-[(4-dimethylaminophenyl)methylidene]-1,3-thiazolidine-2,4-dione, 3-[3-(3,6-dichloro-9H-carbazol-9-yl)-2-hydroxypropyl]-5-[4-(dimethylamino)benzylidene]-1,3-thiazolidine-2,4-dione
| Molecular Formula | C27H23Cl2N3O3S |
|---|---|
| Molecular Weight | 539.08 g/mol |
| LogP | 6.2647 |
| Topological Polar Surface Area | 65.78 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 539.08374 |
| Heavy Atoms | 36 |
| Complexity | 1469.8495 |
Chemical Identifiers
| CAS Number | 312631-89-3 |
|---|---|
| SMILES | CN(C)C1=CC=C(C=C1)/C=C/2\C(=O)N(C(=O)S2)CC(CN3C4=C(C=C(C=C4)Cl)C5=C3C=CC(=C5)Cl)O |
Product Overview
BAS 00727823 (CAS 312631-89-3), with molecular formula C27H23Cl2N3O3S and molecular weight 539.08 g/mol. IUPAC: (5E)-3-[3-(3,6-dichlorocarbazol-9-yl)-2-hydroxypropyl]-5-[[4-(dimethylamino)phenyl]methylidene]-1,3-thiazolidine-2,4-dione.
Chemical Property Profile of BAS 00727823
Property Insights of BAS 00727823
The XLogP value of 6.2647 indicates that BAS 00727823 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 65.78 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00727823. Following Lipinski's Rule of Five, BAS 00727823 has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 00727823?
The CAS number of BAS 00727823 is 312631-89-3.
What is the molecular formula of BAS 00727823?
The molecular formula of BAS 00727823 is C27H23Cl2N3O3S.
What is the molecular weight of BAS 00727823?
The molecular weight of BAS 00727823 is 539.08 g/mol.
Where can I buy BAS 00727823?
You can request a quote for BAS 00727823 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00727823?
Yes, KEHONG BIO provides custom synthesis services for BAS 00727823 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.