BAS 00664639
TL;DR: BAS 00664639 (CAS 1442419-72-8) is a chemical compound with molecular formula C23H18ClFN2O4S and molecular weight 472.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl (2Z)-2-[(2-chloro-6-fluorophenyl)methylidene]-5-(4-methoxyphenyl)-7-methyl-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Also Known As: BAS 00664639, methyl (2Z)-2-[(2-chloro-6-fluorophenyl)methylidene]-5-(4-methoxyphenyl)-7-methyl-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate, methyl (2Z)-2-(2-chloro-6-fluorobenzylidene)-5-(4-methoxyphenyl)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate, (Z)-methyl 2-(2-chloro-6-fluorobenzylidene)-5-(4-methoxyphenyl)-7-methyl-3-oxo-3,5-dihydro-2H-thiazolo[3,2-a]pyrimidine-6-carboxylate, METHYL (2Z)-2-[(2-CHLORO-6-FLUOROPHENYL)METHYLIDENE]-5-(4-METHOXYPHENYL)-7-METHYL-3-OXO-2H,3H,5H-[1,3]THIAZOLO[3,2-A]PYRIMIDINE-6-CARBOXYLATE
| Molecular Formula | C23H18ClFN2O4S |
|---|---|
| Molecular Weight | 472.07 g/mol |
| LogP | 3.2093 |
| Topological Polar Surface Area | 69.89 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 472.06598 |
| Heavy Atoms | 32 |
| Complexity | 1403.4036 |
Chemical Identifiers
| CAS Number | 1442419-72-8 |
|---|---|
| SMILES | CC1=C(C(N2C(=O)/C(=C/C3=C(C=CC=C3Cl)F)/SC2=N1)C4=CC=C(C=C4)OC)C(=O)OC |
Product Overview
BAS 00664639 (CAS 1442419-72-8), with molecular formula C23H18ClFN2O4S and molecular weight 472.07 g/mol. IUPAC: methyl (2Z)-2-[(2-chloro-6-fluorophenyl)methylidene]-5-(4-methoxyphenyl)-7-methyl-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate.
Chemical Property Profile of BAS 00664639
Property Insights of BAS 00664639
The XLogP value of 3.2093 indicates that BAS 00664639 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.89 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00664639. Following Lipinski's Rule of Five, BAS 00664639 has 0 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 00664639?
The CAS number of BAS 00664639 is 1442419-72-8.
What is the molecular formula of BAS 00664639?
The molecular formula of BAS 00664639 is C23H18ClFN2O4S.
What is the molecular weight of BAS 00664639?
The molecular weight of BAS 00664639 is 472.07 g/mol.
Where can I buy BAS 00664639?
You can request a quote for BAS 00664639 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00664639?
Yes, KEHONG BIO provides custom synthesis services for BAS 00664639 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.