2-methyl-N-[(8-methyl-3,4-dihydro-2H-1,5-benzodioxepin-7-yl)methyl]-2,3-dihydro-1-benzofuran-5-carboxamide
Chemical Structure Depiction of
2-methyl-N-[(8-methyl-3,4-dihydro-2H-1,5-benzodioxepin-7-yl)methyl]-2,3-dihydro-1-benzofuran-5-carboxamide
2-methyl-N-[(8-methyl-3,4-dihydro-2H-1,5-benzodioxepin-7-yl)methyl]-2,3-dihydro-1-benzofuran-5-carboxamide
Compound characteristics
| Compound ID: | J031-1206 |
| Compound Name: | 2-methyl-N-[(8-methyl-3,4-dihydro-2H-1,5-benzodioxepin-7-yl)methyl]-2,3-dihydro-1-benzofuran-5-carboxamide |
| Molecular Weight: | 353.42 |
| Molecular Formula: | C21 H23 N O4 |
| Smiles: | CC1Cc2cc(ccc2O1)C(NCc1cc2c(cc1C)OCCCO2)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.0003 |
| logD: | 3.0002 |
| logSw: | -3.0586 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.208 |
| InChI Key: | IGTYYNKTXOEGMR-CQSZACIVSA-N |