BAS 00622315
TL;DR: BAS 00622315 (CAS 313068-68-7) is a chemical compound with molecular formula C23H19ClN2O4S and molecular weight 454.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl (2Z)-5-(4-chlorophenyl)-2-[(4-hydroxyphenyl)methylidene]-7-methyl-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Also Known As: BAS 00622315, (Z)-ethyl 5-(4-chlorophenyl)-2-(4-hydroxybenzylidene)-7-methyl-3-oxo-3,5-dihydro-2H-thiazolo[3,2-a]pyrimidine-6-carboxylate, ethyl (2Z)-5-(4-chlorophenyl)-2-(4-hydroxybenzylidene)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate, ETHYL (2Z)-5-(4-CHLOROPHENYL)-2-[(4-HYDROXYPHENYL)METHYLIDENE]-7-METHYL-3-OXO-2H,3H,5H-[1,3]THIAZOLO[3,2-A]PYRIMIDINE-6-CARBOXYLATE, ethyl (2Z)-5-(4-chlorophenyl)-2-[(4-hydroxyphenyl)methylidene]-7-methyl-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
| Molecular Formula | C23H19ClN2O4S |
|---|---|
| Molecular Weight | 454.08 g/mol |
| LogP | 3.1573 |
| Topological Polar Surface Area | 80.89 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 454.0754 |
| Heavy Atoms | 31 |
| Complexity | 1352.5433 |
Chemical Identifiers
| CAS Number | 313068-68-7 |
|---|---|
| SMILES | CCOC(=O)C1=C(N=C2N(C1C3=CC=C(C=C3)Cl)C(=O)/C(=C/C4=CC=C(C=C4)O)/S2)C |
Product Overview
BAS 00622315 (CAS 313068-68-7), with molecular formula C23H19ClN2O4S and molecular weight 454.08 g/mol. IUPAC: ethyl (2Z)-5-(4-chlorophenyl)-2-[(4-hydroxyphenyl)methylidene]-7-methyl-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate.
Chemical Property Profile of BAS 00622315
Property Insights of BAS 00622315
The XLogP value of 3.1573 indicates that BAS 00622315 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 80.89 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00622315. Following Lipinski's Rule of Five, BAS 00622315 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 00622315?
The CAS number of BAS 00622315 is 313068-68-7.
What is the molecular formula of BAS 00622315?
The molecular formula of BAS 00622315 is C23H19ClN2O4S.
What is the molecular weight of BAS 00622315?
The molecular weight of BAS 00622315 is 454.08 g/mol.
Where can I buy BAS 00622315?
You can request a quote for BAS 00622315 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00622315?
Yes, KEHONG BIO provides custom synthesis services for BAS 00622315 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.