3-[(4-bromoanilino)methyl]-1,3-benzoxazole-2(3H)-thione
Chemical Structure Depiction of
3-[(4-bromoanilino)methyl]-1,3-benzoxazole-2(3H)-thione
3-[(4-bromoanilino)methyl]-1,3-benzoxazole-2(3H)-thione
Compound characteristics
| Compound ID: | 8007-2144 |
| Compound Name: | 3-[(4-bromoanilino)methyl]-1,3-benzoxazole-2(3H)-thione |
| Molecular Weight: | 335.22 |
| Molecular Formula: | C14 H11 Br N2 O S |
| Smiles: | C(Nc1ccc(cc1)[Br])N1C(Oc2ccccc12)=S |
| Stereo: | ACHIRAL |
| logP: | 4.553 |
| logD: | 4.553 |
| logSw: | -4.529 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 21.0345 |
| InChI Key: | ULKOYGDBYOLXHY-UHFFFAOYSA-N |