N-[4-(4-ethyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-6-yl)-5-methyl-1,3-thiazol-2-yl]-3-methylbenzamide
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]-3-methylbenzamide
N-[4-(4-ethyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-6-yl)-5-methyl-1,3-thiazol-2-yl]-3-methylbenzamide
Compound characteristics
Compound ID: | D437-0394 |
Compound Name: | N-[4-(4-ethyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-6-yl)-5-methyl-1,3-thiazol-2-yl]-3-methylbenzamide |
Molecular Weight: | 407.49 |
Molecular Formula: | C22 H21 N3 O3 S |
Smiles: | CCN1C(COc2ccc(cc12)c1c(C)sc(NC(c2cccc(C)c2)=O)n1)=O |
Stereo: | ACHIRAL |
logP: | 4.299 |
logD: | 4.274 |
logSw: | -4.3334 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 57.701 |
InChI Key: | FBIZEPPUFMRSKI-UHFFFAOYSA-N |