1-(4-acetyl-3,4-dihydro-2H-1,4-benzoxazine-6-sulfonyl)-N-(4-ethoxyphenyl)piperidine-4-carboxamide
Chemical Structure Depiction of
1-(4-acetyl-3,4-dihydro-2H-1,4-benzoxazine-6-sulfonyl)-N-(4-ethoxyphenyl)piperidine-4-carboxamide
1-(4-acetyl-3,4-dihydro-2H-1,4-benzoxazine-6-sulfonyl)-N-(4-ethoxyphenyl)piperidine-4-carboxamide
Compound characteristics
| Compound ID: | E557-2354 |
| Compound Name: | 1-(4-acetyl-3,4-dihydro-2H-1,4-benzoxazine-6-sulfonyl)-N-(4-ethoxyphenyl)piperidine-4-carboxamide |
| Molecular Weight: | 487.57 |
| Molecular Formula: | C24 H29 N3 O6 S |
| Smiles: | CCOc1ccc(cc1)NC(C1CCN(CC1)S(c1ccc2c(c1)N(CCO2)C(C)=O)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5363 |
| logD: | 2.5362 |
| logSw: | -3.0147 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 86.168 |
| InChI Key: | GDBMHGRTYRQROA-UHFFFAOYSA-N |