N~2~-[(2-chlorophenyl)methyl]-N-[(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)methyl]-N~2~-(methanesulfonyl)glycinamide
Chemical Structure Depiction of
N~2~-[(2-chlorophenyl)methyl]-N-[(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)methyl]-N~2~-(methanesulfonyl)glycinamide
N~2~-[(2-chlorophenyl)methyl]-N-[(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)methyl]-N~2~-(methanesulfonyl)glycinamide
Compound characteristics
| Compound ID: | J031-2356 |
| Compound Name: | N~2~-[(2-chlorophenyl)methyl]-N-[(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)methyl]-N~2~-(methanesulfonyl)glycinamide |
| Molecular Weight: | 438.93 |
| Molecular Formula: | C20 H23 Cl N2 O5 S |
| Smiles: | CS(N(CC(NCc1ccc2c(c1)OCCCO2)=O)Cc1ccccc1[Cl])(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2368 |
| logD: | 2.2368 |
| logSw: | -3.2549 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.732 |
| InChI Key: | AUTSGHJSAXSCBT-UHFFFAOYSA-N |