N-[2-(3,4-dimethoxyphenyl)ethyl]-8-(methanesulfonyl)-3-methyl-2-oxo-1-oxa-8-azaspiro[4.5]dec-3-ene-4-carboxamide
Chemical Structure Depiction of
N-[2-(3,4-dimethoxyphenyl)ethyl]-8-(methanesulfonyl)-3-methyl-2-oxo-1-oxa-8-azaspiro[4.5]dec-3-ene-4-carboxamide
N-[2-(3,4-dimethoxyphenyl)ethyl]-8-(methanesulfonyl)-3-methyl-2-oxo-1-oxa-8-azaspiro[4.5]dec-3-ene-4-carboxamide
Compound characteristics
| Compound ID: | G016-0628 |
| Compound Name: | N-[2-(3,4-dimethoxyphenyl)ethyl]-8-(methanesulfonyl)-3-methyl-2-oxo-1-oxa-8-azaspiro[4.5]dec-3-ene-4-carboxamide |
| Molecular Weight: | 452.53 |
| Molecular Formula: | C21 H28 N2 O7 S |
| Smiles: | CC1=C(C(NCCc2ccc(c(c2)OC)OC)=O)C2(CCN(CC2)S(C)(=O)=O)OC1=O |
| Stereo: | ACHIRAL |
| logP: | 0.7039 |
| logD: | 0.7039 |
| logSw: | -2.3792 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 91.863 |
| InChI Key: | CUMAXCMTDVGNOM-UHFFFAOYSA-N |