1-(4-acetyl-3,4-dihydro-2H-1,4-benzoxazine-6-sulfonyl)-N-[(4-chlorophenyl)methyl]piperidine-4-carboxamide
Chemical Structure Depiction of
1-(4-acetyl-3,4-dihydro-2H-1,4-benzoxazine-6-sulfonyl)-N-[(4-chlorophenyl)methyl]piperidine-4-carboxamide
1-(4-acetyl-3,4-dihydro-2H-1,4-benzoxazine-6-sulfonyl)-N-[(4-chlorophenyl)methyl]piperidine-4-carboxamide
Compound characteristics
| Compound ID: | E557-2442 |
| Compound Name: | 1-(4-acetyl-3,4-dihydro-2H-1,4-benzoxazine-6-sulfonyl)-N-[(4-chlorophenyl)methyl]piperidine-4-carboxamide |
| Molecular Weight: | 491.99 |
| Molecular Formula: | C23 H26 Cl N3 O5 S |
| Smiles: | CC(N1CCOc2ccc(cc12)S(N1CCC(CC1)C(NCc1ccc(cc1)[Cl])=O)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4509 |
| logD: | 2.4509 |
| logSw: | -3.4529 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.366 |
| InChI Key: | BIODSXHMBFPXRU-UHFFFAOYSA-N |