ethyl N-[(7S)-1,2,3-trimethoxy-10-methylsulfanyl-9-oxo-6,7-dihydro-5H-benzo[a]heptalen-7-yl]carbamate
ethyl N-[(7S)-1,2,3-trimethoxy-10-methylsulfanyl-9-oxo-6,7-dihydro-5H-benzo[a]heptalen-7-yl]carbamate
| Molecular Formula | C23H27NO6S |
|---|---|
| Molecular Weight | 445.5 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 108.0 A2 |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 445.1559 |
| Heavy Atoms | 31 |
| Complexity | 776.0 |
Chemical Identifiers
| CAS Number | 63620-51-9 |
|---|---|
| SMILES | CCOC(=O)NC1CCC2=CC(=C(C(=C2C3=CC=C(C(=O)C=C13)SC)OC)OC)OC |
| InChIKey | SMEGTTUCKYOLLP-INIZCTEOSA-N |
📖 Product Overview
ethyl N-[(7S)-1,2,3-trimethoxy-10-methylsulfanyl-9-oxo-6,7-dihydro-5H-benzo[a]heptalen-7-yl]carbamate (CAS: 63620-51-9) is a chemical compound with molecular formula C23H27NO6S and molecular weight 445.5 g/mol. Its IUPAC systematic name is ethyl N-[(7S)-1,2,3-trimethoxy-10-methylsulfanyl-9-oxo-6,7-dihydro-5H-benzo[a]heptalen-7-yl]carbamate.
SMEGTTUCKYOLLP-INIZCTEOSA-N.
SMILES: CCOC(=O)NC1CCC2=CC(=C(C(=C2C3=CC=C(C(=O)C=C13)SC)OC)OC)OC.
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Multi-source research profile: chemical properties, regulatory status, and sourcing guide for ethyl N-[(7S)-1,2,3-trimethoxy-10-methylsulfanyl-9-oxo-6,7-dihydro-5H-benzo[a]heptalen-7-yl]carbamate.
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