BAS 00778532
TL;DR: BAS 00778532 (CAS 321689-43-4) is a chemical compound with molecular formula C27H23N3O6S and molecular weight 517.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl (2Z)-2-(1-acetyl-2-oxoindol-3-ylidene)-5-(4-methoxyphenyl)-7-methyl-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Also Known As: BAS 00778532, ethyl (2Z)-2-(1-acetyl-2-oxo-1,2-dihydro-3H-indol-3-ylidene)-5-(4-methoxyphenyl)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate, (Z)-ethyl 2-(1-acetyl-2-oxoindolin-3-ylidene)-5-(4-methoxyphenyl)-7-methyl-3-oxo-3,5-dihydro-2H-thiazolo[3,2-a]pyrimidine-6-carboxylate, ethyl (2Z)-2-(1-acetyl-2-oxoindol-3-ylidene)-5-(4-methoxyphenyl)-7-methyl-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate, ethyl 2-(1-acetyl-2-oxo-1,2-dihydro-3H-indol-3-ylidene)-5-(4-methoxyphenyl)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
| Molecular Formula | C27H23N3O6S |
|---|---|
| Molecular Weight | 517.13 g/mol |
| LogP | 2.0702 |
| Topological Polar Surface Area | 107.27 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 4 |
| Exact Mass | 517.13074 |
| Heavy Atoms | 37 |
| Complexity | 1679.7817 |
Chemical Identifiers
| CAS Number | 321689-43-4 |
|---|---|
| SMILES | CCOC(=O)C1=C(N=C2N(C1C3=CC=C(C=C3)OC)C(=O)/C(=C/4\C5=CC=CC=C5N(C4=O)C(=O)C)/S2)C |
Product Overview
BAS 00778532 (CAS 321689-43-4), with molecular formula C27H23N3O6S and molecular weight 517.13 g/mol. IUPAC: ethyl (2Z)-2-(1-acetyl-2-oxoindol-3-ylidene)-5-(4-methoxyphenyl)-7-methyl-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate.
Chemical Property Profile of BAS 00778532
Property Insights of BAS 00778532
The XLogP value of 2.0702 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 00778532. The TPSA of 107.27 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00778532. Following Lipinski's Rule of Five, BAS 00778532 has 0 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 00778532?
The CAS number of BAS 00778532 is 321689-43-4.
What is the molecular formula of BAS 00778532?
The molecular formula of BAS 00778532 is C27H23N3O6S.
What is the molecular weight of BAS 00778532?
The molecular weight of BAS 00778532 is 517.13 g/mol.
Where can I buy BAS 00778532?
You can request a quote for BAS 00778532 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00778532?
Yes, KEHONG BIO provides custom synthesis services for BAS 00778532 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.