N-[(2,5-dimethoxyphenyl)methyl]-3-(3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonyl)propanamide
Chemical Structure Depiction of
N-[(2,5-dimethoxyphenyl)methyl]-3-(3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonyl)propanamide
N-[(2,5-dimethoxyphenyl)methyl]-3-(3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonyl)propanamide
Compound characteristics
| Compound ID: | E975-1238 |
| Compound Name: | N-[(2,5-dimethoxyphenyl)methyl]-3-(3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonyl)propanamide |
| Molecular Weight: | 434.47 |
| Molecular Formula: | C20 H22 N2 O7 S |
| Smiles: | CN1C(=O)Oc2cc(ccc12)S(CCC(NCc1cc(ccc1OC)OC)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.4309 |
| logD: | 1.4309 |
| logSw: | -2.5278 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 91.515 |
| InChI Key: | LJIFEZHAPRIULR-UHFFFAOYSA-N |