methyl 2-[4-(6-methyl-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)butanamido]benzoate
Chemical Structure Depiction of
methyl 2-[4-(6-methyl-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)butanamido]benzoate
methyl 2-[4-(6-methyl-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)butanamido]benzoate
Compound characteristics
| Compound ID: | C798-0337 |
| Compound Name: | methyl 2-[4-(6-methyl-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)butanamido]benzoate |
| Molecular Weight: | 382.41 |
| Molecular Formula: | C21 H22 N2 O5 |
| Smiles: | Cc1ccc2c(c1)N(CCCC(Nc1ccccc1C(=O)OC)=O)C(CO2)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0004 |
| logD: | 1.9748 |
| logSw: | -2.8332 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.672 |
| InChI Key: | XGTLMPWLQNTJQG-UHFFFAOYSA-N |