N-(3-chloro-2-methylphenyl)-3-methyl-2-oxo-1-oxaspiro[4.5]dec-3-ene-4-carboxamide
Chemical Structure Depiction of
N-(3-chloro-2-methylphenyl)-3-methyl-2-oxo-1-oxaspiro[4.5]dec-3-ene-4-carboxamide
N-(3-chloro-2-methylphenyl)-3-methyl-2-oxo-1-oxaspiro[4.5]dec-3-ene-4-carboxamide
Compound characteristics
| Compound ID: | C533-1281 |
| Compound Name: | N-(3-chloro-2-methylphenyl)-3-methyl-2-oxo-1-oxaspiro[4.5]dec-3-ene-4-carboxamide |
| Molecular Weight: | 333.81 |
| Molecular Formula: | C18 H20 Cl N O3 |
| Smiles: | CC1=C(C(Nc2cccc(c2C)[Cl])=O)C2(CCCCC2)OC1=O |
| Stereo: | ACHIRAL |
| logP: | 4.2078 |
| logD: | 4.1985 |
| logSw: | -4.3475 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.457 |
| InChI Key: | AKLBSXWRGOFMAY-UHFFFAOYSA-N |