N-[(3-methoxyphenyl)methyl]-3-(3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-sulfonyl)propanamide
Chemical Structure Depiction of
N-[(3-methoxyphenyl)methyl]-3-(3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-sulfonyl)propanamide
N-[(3-methoxyphenyl)methyl]-3-(3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-sulfonyl)propanamide
Compound characteristics
| Compound ID: | E511-0381 |
| Compound Name: | N-[(3-methoxyphenyl)methyl]-3-(3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-sulfonyl)propanamide |
| Molecular Weight: | 404.44 |
| Molecular Formula: | C19 H20 N2 O6 S |
| Smiles: | COc1cccc(CNC(CCS(c2ccc3c(c2)NC(CO3)=O)(=O)=O)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 0.8373 |
| logD: | 0.8372 |
| logSw: | -2.2021 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 94.289 |
| InChI Key: | LHIKTAFPVCUACT-UHFFFAOYSA-N |