N~2~-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-N~2~-(methanesulfonyl)-N-[(8-methoxy-3,4-dihydro-2H-1,5-benzodioxepin-7-yl)methyl]glycinamide
Chemical Structure Depiction of
N~2~-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-N~2~-(methanesulfonyl)-N-[(8-methoxy-3,4-dihydro-2H-1,5-benzodioxepin-7-yl)methyl]glycinamide
N~2~-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-N~2~-(methanesulfonyl)-N-[(8-methoxy-3,4-dihydro-2H-1,5-benzodioxepin-7-yl)methyl]glycinamide
Compound characteristics
| Compound ID: | J031-2345 |
| Compound Name: | N~2~-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-N~2~-(methanesulfonyl)-N-[(8-methoxy-3,4-dihydro-2H-1,5-benzodioxepin-7-yl)methyl]glycinamide |
| Molecular Weight: | 492.55 |
| Molecular Formula: | C23 H28 N2 O8 S |
| Smiles: | COc1cc2c(cc1CNC(CN(c1ccc3c(c1)OCCCO3)S(C)(=O)=O)=O)OCCCO2 |
| Stereo: | ACHIRAL |
| logP: | 1.1075 |
| logD: | 1.1075 |
| logSw: | -2.4979 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 95.966 |
| InChI Key: | NWBKJGFSINWVCJ-UHFFFAOYSA-N |