N-cyclopentyl-8-methyl-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide
Chemical Structure Depiction of
N-cyclopentyl-8-methyl-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide
N-cyclopentyl-8-methyl-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide
Compound characteristics
| Compound ID: | J031-0513F |
| Compound Name: | N-cyclopentyl-8-methyl-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide |
| Molecular Weight: | 275.35 |
| Molecular Formula: | C16 H21 N O3 |
| Smiles: | Cc1cc2c(cc1C(NC1CCCC1)=O)OCCCO2 |
| Stereo: | ACHIRAL |
| logP: | 2.7281 |
| logD: | 2.7281 |
| logSw: | -3.0251 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.897 |
| InChI Key: | RHKGJGURGNCDOY-UHFFFAOYSA-N |