8-methyl-N-(3-methylphenyl)-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide
Chemical Structure Depiction of
8-methyl-N-(3-methylphenyl)-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide
8-methyl-N-(3-methylphenyl)-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide
Compound characteristics
Compound ID: | J031-0522 |
Compound Name: | 8-methyl-N-(3-methylphenyl)-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide |
Molecular Weight: | 297.35 |
Molecular Formula: | C18 H19 N O3 |
Smiles: | Cc1cccc(c1)NC(c1cc2c(cc1C)OCCCO2)=O |
Stereo: | ACHIRAL |
logP: | 3.2365 |
logD: | 3.2365 |
logSw: | -3.3788 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 39.484 |
InChI Key: | UNQYTJYRTCKNBZ-UHFFFAOYSA-N |