BAS 00996415
TL;DR: BAS 00996415 (CAS 328264-08-0) is a chemical compound with molecular formula C26H21N3O5S and molecular weight 487.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl (2Z)-5-(1,3-benzodioxol-5-yl)-2-(1H-indol-3-ylmethylidene)-7-methyl-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Also Known As: BAS 00996415, ethyl (2Z)-5-(1,3-benzodioxol-5-yl)-2-(1H-indol-3-ylmethylidene)-7-methyl-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate, (Z)-ethyl 2-((1H-indol-3-yl)methylene)-5-(benzo[d][1,3]dioxol-5-yl)-7-methyl-3-oxo-3,5-dihydro-2H-thiazolo[3,2-a]pyrimidine-6-carboxylate, ethyl (2Z)-5-(1,3-benzodioxol-5-yl)-2-(1H-indol-3-ylmethylidene)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate, ETHYL (2Z)-5-(2H-1,3-BENZODIOXOL-5-YL)-2-[(1H-INDOL-3-YL)METHYLIDENE]-7-METHYL-3-OXO-2H,3H,5H-[1,3]THIAZOLO[3,2-A]PYRIMIDINE-6-CARBOXYLATE
| Molecular Formula | C26H21N3O5S |
|---|---|
| Molecular Weight | 487.12 g/mol |
| LogP | 3.0083 |
| Topological Polar Surface Area | 94.91 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 487.12018 |
| Heavy Atoms | 35 |
| Complexity | 1708.6309 |
Chemical Identifiers
| CAS Number | 328264-08-0 |
|---|---|
| SMILES | CCOC(=O)C1=C(N=C2N(C1C3=CC4=C(C=C3)OCO4)C(=O)/C(=C/C5=CNC6=CC=CC=C65)/S2)C |
Product Overview
BAS 00996415 (CAS 328264-08-0), with molecular formula C26H21N3O5S and molecular weight 487.12 g/mol. IUPAC: ethyl (2Z)-5-(1,3-benzodioxol-5-yl)-2-(1H-indol-3-ylmethylidene)-7-methyl-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate.
Chemical Property Profile of BAS 00996415
Property Insights of BAS 00996415
The XLogP value of 3.0083 indicates that BAS 00996415 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 94.91 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00996415. Following Lipinski's Rule of Five, BAS 00996415 has 1 hydrogen bond donor(s) and 7 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 00996415?
The CAS number of BAS 00996415 is 328264-08-0.
What is the molecular formula of BAS 00996415?
The molecular formula of BAS 00996415 is C26H21N3O5S.
What is the molecular weight of BAS 00996415?
The molecular weight of BAS 00996415 is 487.12 g/mol.
Where can I buy BAS 00996415?
You can request a quote for BAS 00996415 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00996415?
Yes, KEHONG BIO provides custom synthesis services for BAS 00996415 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.