N-(2,5-dimethoxyphenyl)-3-(3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-sulfonyl)propanamide
Chemical Structure Depiction of
N-(2,5-dimethoxyphenyl)-3-(3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-sulfonyl)propanamide
N-(2,5-dimethoxyphenyl)-3-(3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-sulfonyl)propanamide
Compound characteristics
| Compound ID: | E511-0349 |
| Compound Name: | N-(2,5-dimethoxyphenyl)-3-(3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-sulfonyl)propanamide |
| Molecular Weight: | 420.44 |
| Molecular Formula: | C19 H20 N2 O7 S |
| Smiles: | COc1ccc(c(c1)NC(CCS(c1ccc2c(c1)NC(CO2)=O)(=O)=O)=O)OC |
| Stereo: | ACHIRAL |
| logP: | 0.7232 |
| logD: | 0.7183 |
| logSw: | -2.2591 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 99.899 |
| InChI Key: | ADLJCJCTSDQTMT-UHFFFAOYSA-N |