N-[(3-bromophenyl)methyl]-3-(piperidine-1-carbonyl)-1,2-benzoxazole-5-sulfonamide
Chemical Structure Depiction of
N-[(3-bromophenyl)methyl]-3-(piperidine-1-carbonyl)-1,2-benzoxazole-5-sulfonamide
N-[(3-bromophenyl)methyl]-3-(piperidine-1-carbonyl)-1,2-benzoxazole-5-sulfonamide
Compound characteristics
| Compound ID: | L995-0605 |
| Compound Name: | N-[(3-bromophenyl)methyl]-3-(piperidine-1-carbonyl)-1,2-benzoxazole-5-sulfonamide |
| Molecular Weight: | 478.36 |
| Molecular Formula: | C20 H20 Br N3 O4 S |
| Smiles: | C1CCN(CC1)C(c1c2cc(ccc2on1)S(NCc1cccc(c1)[Br])(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8352 |
| logD: | 3.8348 |
| logSw: | -3.9276 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.844 |
| InChI Key: | ISGKSJZKWIMYNM-UHFFFAOYSA-N |