N-[4-(4-ethyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-6-yl)-5-methyl-1,3-thiazol-2-yl]-4-fluorobenzamide
Chemical Structure Depiction of
N-[4-(4-ethyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-6-yl)-5-methyl-1,3-thiazol-2-yl]-4-fluorobenzamide
N-[4-(4-ethyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-6-yl)-5-methyl-1,3-thiazol-2-yl]-4-fluorobenzamide
Compound characteristics
| Compound ID: | D437-0412 |
| Compound Name: | N-[4-(4-ethyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-6-yl)-5-methyl-1,3-thiazol-2-yl]-4-fluorobenzamide |
| Molecular Weight: | 411.45 |
| Molecular Formula: | C21 H18 F N3 O3 S |
| Smiles: | CCN1C(COc2ccc(cc12)c1c(C)sc(NC(c2ccc(cc2)F)=O)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.957 |
| logD: | 3.8966 |
| logSw: | -4.038 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.701 |
| InChI Key: | GSMYVFOJXAKHQG-UHFFFAOYSA-N |