ethyl 4-[3-methyl-2-oxo-8-(thiophene-2-sulfonyl)-1-oxa-8-azaspiro[4.5]dec-3-ene-4-carbonyl]piperazine-1-carboxylate
Chemical Structure Depiction of
ethyl 4-[3-methyl-2-oxo-8-(thiophene-2-sulfonyl)-1-oxa-8-azaspiro[4.5]dec-3-ene-4-carbonyl]piperazine-1-carboxylate
ethyl 4-[3-methyl-2-oxo-8-(thiophene-2-sulfonyl)-1-oxa-8-azaspiro[4.5]dec-3-ene-4-carbonyl]piperazine-1-carboxylate
Compound characteristics
| Compound ID: | G016-1002 |
| Compound Name: | ethyl 4-[3-methyl-2-oxo-8-(thiophene-2-sulfonyl)-1-oxa-8-azaspiro[4.5]dec-3-ene-4-carbonyl]piperazine-1-carboxylate |
| Molecular Weight: | 497.59 |
| Molecular Formula: | C21 H27 N3 O7 S2 |
| Smiles: | CCOC(N1CCN(CC1)C(C1=C(C)C(=O)OC12CCN(CC2)S(c1cccs1)(=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.6693 |
| logD: | 1.6693 |
| logSw: | -2.3486 |
| Hydrogen bond acceptors count: | 13 |
| Polar surface area: | 93.03 |
| InChI Key: | MGYKVXWXORPPRC-UHFFFAOYSA-N |