tert-butyl 4-(3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-sulfonyl)piperazine-1-carboxylate
Chemical Structure Depiction of
tert-butyl 4-(3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-sulfonyl)piperazine-1-carboxylate
tert-butyl 4-(3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-sulfonyl)piperazine-1-carboxylate
Compound characteristics
| Compound ID: | F537-0445 |
| Compound Name: | tert-butyl 4-(3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-sulfonyl)piperazine-1-carboxylate |
| Molecular Weight: | 397.45 |
| Molecular Formula: | C17 H23 N3 O6 S |
| Smiles: | CC(C)(C)OC(N1CCN(CC1)S(c1ccc2c(c1)NC(CO2)=O)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.8508 |
| logD: | 1.8506 |
| logSw: | -2.7461 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 87.109 |
| InChI Key: | SPIBMWOXIVPXRH-UHFFFAOYSA-N |