4-acetyl-6-chloro-N-[2-(3,4-dimethoxyphenyl)ethyl]-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonamide
Chemical Structure Depiction of
4-acetyl-6-chloro-N-[2-(3,4-dimethoxyphenyl)ethyl]-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonamide
4-acetyl-6-chloro-N-[2-(3,4-dimethoxyphenyl)ethyl]-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonamide
Compound characteristics
| Compound ID: | E470-2172 |
| Compound Name: | 4-acetyl-6-chloro-N-[2-(3,4-dimethoxyphenyl)ethyl]-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonamide |
| Molecular Weight: | 454.93 |
| Molecular Formula: | C20 H23 Cl N2 O6 S |
| Smiles: | CC(N1CCOc2cc(c(cc12)[Cl])S(NCCc1ccc(c(c1)OC)OC)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2668 |
| logD: | 2.2667 |
| logSw: | -3.3186 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.103 |
| InChI Key: | USROKCFFGDFACQ-UHFFFAOYSA-N |