N-[(4-bromophenyl)methyl]-4H-[1]benzopyrano[3,4-d][1,2]oxazole-8-sulfonamide
Chemical Structure Depiction of
N-[(4-bromophenyl)methyl]-4H-[1]benzopyrano[3,4-d][1,2]oxazole-8-sulfonamide
N-[(4-bromophenyl)methyl]-4H-[1]benzopyrano[3,4-d][1,2]oxazole-8-sulfonamide
Compound characteristics
| Compound ID: | M030-0295 |
| Compound Name: | N-[(4-bromophenyl)methyl]-4H-[1]benzopyrano[3,4-d][1,2]oxazole-8-sulfonamide |
| Molecular Weight: | 421.27 |
| Molecular Formula: | C17 H13 Br N2 O4 S |
| Smiles: | C(c1ccc(cc1)[Br])NS(c1ccc2c(c1)c1c(CO2)cno1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2641 |
| logD: | 3.2638 |
| logSw: | -3.4998 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.18 |
| InChI Key: | CJJDZRIMIJSBGA-UHFFFAOYSA-N |