N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-3-(3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-sulfonyl)propanamide
Chemical Structure Depiction of
N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-3-(3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-sulfonyl)propanamide
N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-3-(3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-sulfonyl)propanamide
Compound characteristics
| Compound ID: | E667-0615 |
| Compound Name: | N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-3-(3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-sulfonyl)propanamide |
| Molecular Weight: | 446.48 |
| Molecular Formula: | C21 H22 N2 O7 S |
| Smiles: | CC(c1ccc2c(c1)OCCO2)NC(CCS(c1ccc2c(c1)NC(CO2)=O)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.3647 |
| logD: | 0.3646 |
| logSw: | -2.2224 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 101.731 |
| InChI Key: | VLTZSGDDBJGCDW-ZDUSSCGKSA-N |