4-(6-methyl-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-N-[2-(2-methylpropanamido)-1,3-benzothiazol-5-yl]butanamide
Chemical Structure Depiction of
4-(6-methyl-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-N-[2-(2-methylpropanamido)-1,3-benzothiazol-5-yl]butanamide
4-(6-methyl-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-N-[2-(2-methylpropanamido)-1,3-benzothiazol-5-yl]butanamide
Compound characteristics
| Compound ID: | F782-1943 |
| Compound Name: | 4-(6-methyl-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-N-[2-(2-methylpropanamido)-1,3-benzothiazol-5-yl]butanamide |
| Molecular Weight: | 466.56 |
| Molecular Formula: | C24 H26 N4 O4 S |
| Smiles: | [H]c1cc2c(cc1NC(CCCN1C(COc3ccc(C)cc13)=O)=O)nc(NC(C(C)C)=O)s2 |
| Stereo: | ACHIRAL |
| logP: | 3.5704 |
| logD: | 3.5701 |
| logSw: | -3.7918 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 80.32 |
| InChI Key: | PQKWBCUCFGLMGW-UHFFFAOYSA-N |