3-methyl-2-oxo-N-[3-(2-oxopyrrolidin-1-yl)propyl]-8-(thiophene-2-sulfonyl)-1-oxa-8-azaspiro[4.5]dec-3-ene-4-carboxamide
Chemical Structure Depiction of
3-methyl-2-oxo-N-[3-(2-oxopyrrolidin-1-yl)propyl]-8-(thiophene-2-sulfonyl)-1-oxa-8-azaspiro[4.5]dec-3-ene-4-carboxamide
3-methyl-2-oxo-N-[3-(2-oxopyrrolidin-1-yl)propyl]-8-(thiophene-2-sulfonyl)-1-oxa-8-azaspiro[4.5]dec-3-ene-4-carboxamide
Compound characteristics
| Compound ID: | G016-1046 |
| Compound Name: | 3-methyl-2-oxo-N-[3-(2-oxopyrrolidin-1-yl)propyl]-8-(thiophene-2-sulfonyl)-1-oxa-8-azaspiro[4.5]dec-3-ene-4-carboxamide |
| Molecular Weight: | 481.59 |
| Molecular Formula: | C21 H27 N3 O6 S2 |
| Smiles: | CC1=C(C(NCCCN2CCCC2=O)=O)C2(CCN(CC2)S(c2cccs2)(=O)=O)OC1=O |
| Stereo: | ACHIRAL |
| logP: | 0.3685 |
| logD: | 0.3684 |
| logSw: | -2.187 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 95.368 |
| InChI Key: | SPXFVQWYLQPORR-UHFFFAOYSA-N |