![ethyl 3-(1,3-benzothiazol-2-yl)-8-[[(2R,6S)-2,6-dimethylpiperidin-1-yl]methyl]-6-ethyl-7-hydroxy-4-oxochromene-2-carboxylate structure](/static/products/121/1212130-66-9.webp)
ethyl 3-(1,3-benzothiazol-2-yl)-8-[[(2R,6S)-2,6-dimethylpiperidin-1-yl]methyl]-6-ethyl-7-hydroxy-4-oxochromene-2-carboxylate
TL;DR: ethyl 3-(1,3-benzothiazol-2-yl)-8-[[(2R,6S)-2,6-dimethylpiperidin-1-yl]methyl]-6-ethyl-7-hydroxy-4-oxochromene-2-carboxylate (CAS 1212130-66-9) is a chemical compound with molecular formula C29H32N2O5S and molecular weight 520.2032 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
ethyl 3-(1,3-benzothiazol-2-yl)-8-[[(2S,6R)-2,6-dimethylpiperidin-1-yl]methyl]-6-ethyl-7-hydroxy-4-oxochromene-2-carboxylate
Also Known As: ethyl 3-(1,3-benzothiazol-2-yl)-8-[[(2R,6S)-2,6-dimethylpiperidin-1-yl]methyl]-6-ethyl-7-hydroxy-4-oxochromene-2-carboxylate, ethyl 3-(benzo[d]thiazol-2-yl)-8-(((2R,6S)-2,6-dimethylpiperidin-1-yl)methyl)-6-ethyl-7-hydroxy-4-oxo-4H-chromene-2-carboxylate, ethyl 8-[((6S,2R)-2,6-dimethylpiperidyl)methyl]-3-benzothiazol-2-yl-6-ethyl-7- hydroxy-4-oxochromene-2-carboxylate
Technical Specifications
| Molecular Formula | C29H32N2O5S |
| Molecular Weight | 520.2032 g/mol |
| XLogP | 6.1 |
| Topological Polar Surface Area (TPSA) | 117.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 520.2032 Da |
| Heavy Atoms | 37 |
| Complexity | 886.0 |
| SMILES | CCC1=CC2=C(C(=C1O)CN3[C@@H](CCC[C@@H]3C)C)OC(=C(C2=O)C4=NC5=CC=CC=C5S4)C(=O)OCC |
| InChIKey | MEBZJBARKPZHQO-CALCHBBNSA-N |
Chemical Property Profile of ethyl 3-(1,3-benzothiazol-2-yl)-8-[[(2R,6S)-2,6-dimethylpiperidin-1-yl]methyl]-6-ethyl-7-hydroxy-4-oxochromene-2-carboxylate
Property Insights of ethyl 3-(1,3-benzothiazol-2-yl)-8-[[(2R,6S)-2,6-dimethylpiperidin-1-yl]methyl]-6-ethyl-7-hydroxy-4-oxochromene-2-carboxylate
The XLogP value of 6.1 indicates that ethyl 3-(1,3-benzothiazol-2-yl)-8-[[(2R,6S)-2,6-dimethylpiperidin-1-yl]methyl]-6-ethyl-7-hydroxy-4-oxochromene-2-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 117.0 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl 3-(1,3-benzothiazol-2-yl)-8-[[(2R,6S)-2,6-dimethylpiperidin-1-yl]methyl]-6-ethyl-7-hydroxy-4-oxochromene-2-carboxylate. Following Lipinski's Rule of Five, ethyl 3-(1,3-benzothiazol-2-yl)-8-[[(2R,6S)-2,6-dimethylpiperidin-1-yl]methyl]-6-ethyl-7-hydroxy-4-oxochromene-2-carboxylate has 1 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of ethyl 3-(1,3-benzothiazol-2-yl)-8-[[(2R,6S)-2,6-dimethylpiperidin-1-yl]methyl]-6-ethyl-7-hydroxy-4-oxochromene-2-carboxylate?
The CAS number of ethyl 3-(1,3-benzothiazol-2-yl)-8-[[(2R,6S)-2,6-dimethylpiperidin-1-yl]methyl]-6-ethyl-7-hydroxy-4-oxochromene-2-carboxylate is 1212130-66-9.
What is the molecular formula of ethyl 3-(1,3-benzothiazol-2-yl)-8-[[(2R,6S)-2,6-dimethylpiperidin-1-yl]methyl]-6-ethyl-7-hydroxy-4-oxochromene-2-carboxylate?
The molecular formula of ethyl 3-(1,3-benzothiazol-2-yl)-8-[[(2R,6S)-2,6-dimethylpiperidin-1-yl]methyl]-6-ethyl-7-hydroxy-4-oxochromene-2-carboxylate is C29H32N2O5S.
What is the molecular weight of ethyl 3-(1,3-benzothiazol-2-yl)-8-[[(2R,6S)-2,6-dimethylpiperidin-1-yl]methyl]-6-ethyl-7-hydroxy-4-oxochromene-2-carboxylate?
The molecular weight of ethyl 3-(1,3-benzothiazol-2-yl)-8-[[(2R,6S)-2,6-dimethylpiperidin-1-yl]methyl]-6-ethyl-7-hydroxy-4-oxochromene-2-carboxylate is 520.2032 g/mol.
Where can I buy ethyl 3-(1,3-benzothiazol-2-yl)-8-[[(2R,6S)-2,6-dimethylpiperidin-1-yl]methyl]-6-ethyl-7-hydroxy-4-oxochromene-2-carboxylate?
You can request a quote for ethyl 3-(1,3-benzothiazol-2-yl)-8-[[(2R,6S)-2,6-dimethylpiperidin-1-yl]methyl]-6-ethyl-7-hydroxy-4-oxochromene-2-carboxylate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for ethyl 3-(1,3-benzothiazol-2-yl)-8-[[(2R,6S)-2,6-dimethylpiperidin-1-yl]methyl]-6-ethyl-7-hydroxy-4-oxochromene-2-carboxylate?
Yes, CoreyChem provides custom synthesis services for ethyl 3-(1,3-benzothiazol-2-yl)-8-[[(2R,6S)-2,6-dimethylpiperidin-1-yl]methyl]-6-ethyl-7-hydroxy-4-oxochromene-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.