N-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methylpropyl]-4-methylbenzamide
Chemical Structure Depiction of
N-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methylpropyl]-4-methylbenzamide
N-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methylpropyl]-4-methylbenzamide
Compound characteristics
| Compound ID: | J031-1042 |
| Compound Name: | N-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methylpropyl]-4-methylbenzamide |
| Molecular Weight: | 339.43 |
| Molecular Formula: | C21 H25 N O3 |
| Smiles: | CC(C)C(c1ccc2c(c1)OCCCO2)NC(c1ccc(C)cc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.0081 |
| logD: | 4.0081 |
| logSw: | -4.0312 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.158 |
| InChI Key: | GWDPWALJBYJNBZ-FQEVSTJZSA-N |