2-(4-chloro-3-methylphenoxy)-N-[(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)methyl]acetamide
Chemical Structure Depiction of
2-(4-chloro-3-methylphenoxy)-N-[(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)methyl]acetamide
2-(4-chloro-3-methylphenoxy)-N-[(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)methyl]acetamide
Compound characteristics
| Compound ID: | J031-1503 |
| Compound Name: | 2-(4-chloro-3-methylphenoxy)-N-[(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)methyl]acetamide |
| Molecular Weight: | 361.82 |
| Molecular Formula: | C19 H20 Cl N O4 |
| Smiles: | Cc1cc(ccc1[Cl])OCC(NCc1ccc2c(c1)OCCCO2)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3795 |
| logD: | 3.3795 |
| logSw: | -3.4075 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.092 |
| InChI Key: | NZNSRFXPNNUYQB-UHFFFAOYSA-N |