3-[(2,4-dimethylanilino)methyl]-1,3-benzoxazole-2(3H)-thione
Chemical Structure Depiction of
3-[(2,4-dimethylanilino)methyl]-1,3-benzoxazole-2(3H)-thione
3-[(2,4-dimethylanilino)methyl]-1,3-benzoxazole-2(3H)-thione
Compound characteristics
| Compound ID: | 8009-3432 |
| Compound Name: | 3-[(2,4-dimethylanilino)methyl]-1,3-benzoxazole-2(3H)-thione |
| Molecular Weight: | 284.38 |
| Molecular Formula: | C16 H16 N2 O S |
| Smiles: | Cc1ccc(c(C)c1)NCN1C(Oc2ccccc12)=S |
| Stereo: | ACHIRAL |
| logP: | 4.4601 |
| logD: | 4.4601 |
| logSw: | -4.3532 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 20.3367 |
| InChI Key: | UXYMWOZHMTVCQE-UHFFFAOYSA-N |