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(S)-3'-ethyl 5'-methyl 2'-amino-1-(2-(benzyloxy)-2-oxoethyl)-6'-methyl-2-oxospiro[indoline-3,4'-pyran]-3',5'-dicarboxylate structure
Fine Chemical

(S)-3'-ethyl 5'-methyl 2'-amino-1-(2-(benzyloxy)-2-oxoethyl)-6'-methyl-2-oxospiro[indoline-3,4'-pyran]-3',5'-dicarboxylate

TL;DR: (S)-3'-ethyl 5'-methyl 2'-amino-1-(2-(benzyloxy)-2-oxoethyl)-6'-methyl-2-oxospiro[indoline-3,4'-pyran]-3',5'-dicarboxylate (CAS 1212076-98-6) is a chemical compound with molecular formula C27H26N2O8 and molecular weight 506.1689 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

3-O'-ethyl 5-O'-methyl (3S)-2'-amino-6'-methyl-2-oxo-1-(2-oxo-2-phenylmethoxyethyl)spiro[indole-3,4'-pyran]-3',5'-dicarboxylate

Also Known As: (S)-3'-ethyl 5'-methyl 2'-amino-1-(2-(benzyloxy)-2-oxoethyl)-6'-methyl-2-oxospiro[indoline-3,4'-pyran]-3',5'-dicarboxylate, 3-O'-ethyl 5-O'-methyl (3S)-2'-amino-6'-methyl-2-oxo-1-(2-oxo-2-phenylmethoxyethyl)spiro[indole-3,4'-pyran]-3',5'-dicarboxylate

CAS Number
1212076-98-6
Molecular Formula
C27H26N2O8
Molecular Weight
506.1689 g/mol
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Technical Specifications

Molecular FormulaC27H26N2O8
Molecular Weight506.1689 g/mol
XLogP2.9
Topological Polar Surface Area (TPSA)134.0 Ų
Hydrogen Bond Donors1
Hydrogen Bond Acceptors9
Rotatable Bonds10
Exact Mass506.1689 Da
Heavy Atoms37
Complexity1010.0
SMILESCCOC(=O)C1=C(OC(=C([C@@]12C3=CC=CC=C3N(C2=O)CC(=O)OCC4=CC=CC=C4)C(=O)OC)C)N
InChIKeySVPAPNDATQNETG-MHZLTWQESA-N

Chemical Property Profile of (S)-3'-ethyl 5'-methyl 2'-amino-1-(2-(benzyloxy)-2-oxoethyl)-6'-methyl-2-oxospiro[indoline-3,4'-pyran]-3',5'-dicarboxylate

XLogP
2.9
TPSA (Topological Polar Surface Area)
134.0
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
9
Rotatable Bonds
10
Heavy Atoms
37
Complexity
1010.0
Exact Mass
506.1689
Monoisotopic Mass
506.1689
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of (S)-3'-ethyl 5'-methyl 2'-amino-1-(2-(benzyloxy)-2-oxoethyl)-6'-methyl-2-oxospiro[indoline-3,4'-pyran]-3',5'-dicarboxylate

The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (S)-3'-ethyl 5'-methyl 2'-amino-1-(2-(benzyloxy)-2-oxoethyl)-6'-methyl-2-oxospiro[indoline-3,4'-pyran]-3',5'-dicarboxylate. The TPSA of 134.0 Ų falls within the moderate polarity range, balancing permeability and solubility for (S)-3'-ethyl 5'-methyl 2'-amino-1-(2-(benzyloxy)-2-oxoethyl)-6'-methyl-2-oxospiro[indoline-3,4'-pyran]-3',5'-dicarboxylate. Following Lipinski's Rule of Five, (S)-3'-ethyl 5'-methyl 2'-amino-1-(2-(benzyloxy)-2-oxoethyl)-6'-methyl-2-oxospiro[indoline-3,4'-pyran]-3',5'-dicarboxylate has 1 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.

Frequently Asked Questions

What is the CAS number of (S)-3'-ethyl 5'-methyl 2'-amino-1-(2-(benzyloxy)-2-oxoethyl)-6'-methyl-2-oxospiro[indoline-3,4'-pyran]-3',5'-dicarboxylate?

The CAS number of (S)-3'-ethyl 5'-methyl 2'-amino-1-(2-(benzyloxy)-2-oxoethyl)-6'-methyl-2-oxospiro[indoline-3,4'-pyran]-3',5'-dicarboxylate is 1212076-98-6.

What is the molecular formula of (S)-3'-ethyl 5'-methyl 2'-amino-1-(2-(benzyloxy)-2-oxoethyl)-6'-methyl-2-oxospiro[indoline-3,4'-pyran]-3',5'-dicarboxylate?

The molecular formula of (S)-3'-ethyl 5'-methyl 2'-amino-1-(2-(benzyloxy)-2-oxoethyl)-6'-methyl-2-oxospiro[indoline-3,4'-pyran]-3',5'-dicarboxylate is C27H26N2O8.

What is the molecular weight of (S)-3'-ethyl 5'-methyl 2'-amino-1-(2-(benzyloxy)-2-oxoethyl)-6'-methyl-2-oxospiro[indoline-3,4'-pyran]-3',5'-dicarboxylate?

The molecular weight of (S)-3'-ethyl 5'-methyl 2'-amino-1-(2-(benzyloxy)-2-oxoethyl)-6'-methyl-2-oxospiro[indoline-3,4'-pyran]-3',5'-dicarboxylate is 506.1689 g/mol.

Where can I buy (S)-3'-ethyl 5'-methyl 2'-amino-1-(2-(benzyloxy)-2-oxoethyl)-6'-methyl-2-oxospiro[indoline-3,4'-pyran]-3',5'-dicarboxylate?

You can request a quote for (S)-3'-ethyl 5'-methyl 2'-amino-1-(2-(benzyloxy)-2-oxoethyl)-6'-methyl-2-oxospiro[indoline-3,4'-pyran]-3',5'-dicarboxylate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for (S)-3'-ethyl 5'-methyl 2'-amino-1-(2-(benzyloxy)-2-oxoethyl)-6'-methyl-2-oxospiro[indoline-3,4'-pyran]-3',5'-dicarboxylate?

Yes, CoreyChem provides custom synthesis services for (S)-3'-ethyl 5'-methyl 2'-amino-1-(2-(benzyloxy)-2-oxoethyl)-6'-methyl-2-oxospiro[indoline-3,4'-pyran]-3',5'-dicarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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