(S)-ethyl 2'-amino-5'-benzoyl-6'-methyl-2-oxospiro[indoline-3,4'-pyran]-3'-carboxylate
TL;DR: (S)-ethyl 2'-amino-5'-benzoyl-6'-methyl-2-oxospiro[indoline-3,4'-pyran]-3'-carboxylate (CAS 1212207-36-7) is a chemical compound with molecular formula C23H20N2O5 and molecular weight 404.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl (3S)-2'-amino-5'-benzoyl-6'-methyl-2-oxospiro[1H-indole-3,4'-pyran]-3'-carboxylate
Also Known As: (S)-ethyl 2'-amino-5'-benzoyl-6'-methyl-2-oxospiro[indoline-3,4'-pyran]-3'-carboxylate, ethyl (3S)-2'-amino-5'-benzoyl-6'-methyl-2-oxospiro[1H-indole-3,4'-pyran]-3'-carboxylate
| Molecular Formula | C23H20N2O5 |
|---|---|
| Molecular Weight | 404.14 g/mol |
| LogP | 2.797 |
| Topological Polar Surface Area | 107.72 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 404.1372 |
| Heavy Atoms | 30 |
| Complexity | 1133.2922 |
Chemical Identifiers
| CAS Number | 1212207-36-7 |
|---|---|
| SMILES | CCOC(=O)C1=C(OC(=C([C@@]12C3=CC=CC=C3NC2=O)C(=O)C4=CC=CC=C4)C)N |
Product Overview
(S)-ethyl 2'-amino-5'-benzoyl-6'-methyl-2-oxospiro[indoline-3,4'-pyran]-3'-carboxylate (CAS 1212207-36-7), with molecular formula C23H20N2O5 and molecular weight 404.14 g/mol. IUPAC: ethyl (3S)-2'-amino-5'-benzoyl-6'-methyl-2-oxospiro[1H-indole-3,4'-pyran]-3'-carboxylate.
Chemical Property Profile of (S)-ethyl 2'-amino-5'-benzoyl-6'-methyl-2-oxospiro[indoline-3,4'-pyran]-3'-carboxylate
Property Insights of (S)-ethyl 2'-amino-5'-benzoyl-6'-methyl-2-oxospiro[indoline-3,4'-pyran]-3'-carboxylate
The XLogP value of 2.797 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (S)-ethyl 2'-amino-5'-benzoyl-6'-methyl-2-oxospiro[indoline-3,4'-pyran]-3'-carboxylate. The TPSA of 107.72 Ų falls within the moderate polarity range, balancing permeability and solubility for (S)-ethyl 2'-amino-5'-benzoyl-6'-methyl-2-oxospiro[indoline-3,4'-pyran]-3'-carboxylate. Following Lipinski's Rule of Five, (S)-ethyl 2'-amino-5'-benzoyl-6'-methyl-2-oxospiro[indoline-3,4'-pyran]-3'-carboxylate has 2 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 (S)-ethyl 2'-amino-5'-benzoyl-6'-methyl-2-oxospiro[indoline-3,4'-pyran]-3'-carboxylate?
The CAS number of (S)-ethyl 2'-amino-5'-benzoyl-6'-methyl-2-oxospiro[indoline-3,4'-pyran]-3'-carboxylate is 1212207-36-7.
What is the molecular formula of (S)-ethyl 2'-amino-5'-benzoyl-6'-methyl-2-oxospiro[indoline-3,4'-pyran]-3'-carboxylate?
The molecular formula of (S)-ethyl 2'-amino-5'-benzoyl-6'-methyl-2-oxospiro[indoline-3,4'-pyran]-3'-carboxylate is C23H20N2O5.
What is the molecular weight of (S)-ethyl 2'-amino-5'-benzoyl-6'-methyl-2-oxospiro[indoline-3,4'-pyran]-3'-carboxylate?
The molecular weight of (S)-ethyl 2'-amino-5'-benzoyl-6'-methyl-2-oxospiro[indoline-3,4'-pyran]-3'-carboxylate is 404.14 g/mol.
Where can I buy (S)-ethyl 2'-amino-5'-benzoyl-6'-methyl-2-oxospiro[indoline-3,4'-pyran]-3'-carboxylate?
You can request a quote for (S)-ethyl 2'-amino-5'-benzoyl-6'-methyl-2-oxospiro[indoline-3,4'-pyran]-3'-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (S)-ethyl 2'-amino-5'-benzoyl-6'-methyl-2-oxospiro[indoline-3,4'-pyran]-3'-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for (S)-ethyl 2'-amino-5'-benzoyl-6'-methyl-2-oxospiro[indoline-3,4'-pyran]-3'-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.