N-[4-(3-oxo-4-propyl-3,4-dihydro-2H-1,4-benzoxazin-6-yl)-1,3-thiazol-2-yl]cyclohexanecarboxamide
Chemical Structure Depiction of
N-[4-(3-oxo-4-propyl-3,4-dihydro-2H-1,4-benzoxazin-6-yl)-1,3-thiazol-2-yl]cyclohexanecarboxamide
N-[4-(3-oxo-4-propyl-3,4-dihydro-2H-1,4-benzoxazin-6-yl)-1,3-thiazol-2-yl]cyclohexanecarboxamide
Compound characteristics
| Compound ID: | D487-0197 |
| Compound Name: | N-[4-(3-oxo-4-propyl-3,4-dihydro-2H-1,4-benzoxazin-6-yl)-1,3-thiazol-2-yl]cyclohexanecarboxamide |
| Molecular Weight: | 399.51 |
| Molecular Formula: | C21 H25 N3 O3 S |
| Smiles: | CCCN1C(COc2ccc(cc12)c1csc(NC(C2CCCCC2)=O)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4172 |
| logD: | 4.4171 |
| logSw: | -4.2866 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.376 |
| InChI Key: | HRUYFVLNPHOYLI-UHFFFAOYSA-N |