ethyl 3-{[8-(ethanesulfonyl)-3-methyl-2-oxo-1-oxa-8-azaspiro[4.5]dec-3-ene-4-carbonyl]amino}benzoate
Chemical Structure Depiction of
ethyl 3-{[8-(ethanesulfonyl)-3-methyl-2-oxo-1-oxa-8-azaspiro[4.5]dec-3-ene-4-carbonyl]amino}benzoate
ethyl 3-{[8-(ethanesulfonyl)-3-methyl-2-oxo-1-oxa-8-azaspiro[4.5]dec-3-ene-4-carbonyl]amino}benzoate
Compound characteristics
| Compound ID: | G016-1233 |
| Compound Name: | ethyl 3-{[8-(ethanesulfonyl)-3-methyl-2-oxo-1-oxa-8-azaspiro[4.5]dec-3-ene-4-carbonyl]amino}benzoate |
| Molecular Weight: | 450.51 |
| Molecular Formula: | C21 H26 N2 O7 S |
| Smiles: | CCOC(c1cccc(c1)NC(C1=C(C)C(=O)OC12CCN(CC2)S(CC)(=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6543 |
| logD: | 2.6541 |
| logSw: | -3.1133 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 96.594 |
| InChI Key: | MXUGVTCQMDPPDI-UHFFFAOYSA-N |