N-[(8-methyl-3,4-dihydro-2H-1,5-benzodioxepin-7-yl)methyl]naphthalene-1-carboxamide
Chemical Structure Depiction of
N-[(8-methyl-3,4-dihydro-2H-1,5-benzodioxepin-7-yl)methyl]naphthalene-1-carboxamide
N-[(8-methyl-3,4-dihydro-2H-1,5-benzodioxepin-7-yl)methyl]naphthalene-1-carboxamide
Compound characteristics
| Compound ID: | J031-1182 |
| Compound Name: | N-[(8-methyl-3,4-dihydro-2H-1,5-benzodioxepin-7-yl)methyl]naphthalene-1-carboxamide |
| Molecular Weight: | 347.41 |
| Molecular Formula: | C22 H21 N O3 |
| Smiles: | Cc1cc2c(cc1CNC(c1cccc3ccccc13)=O)OCCCO2 |
| Stereo: | ACHIRAL |
| logP: | 3.7773 |
| logD: | 3.7773 |
| logSw: | -3.9878 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.534 |
| InChI Key: | JPXQUTDQAURBID-UHFFFAOYSA-N |