N~1~-(4-methyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-6-yl)-N~2~-(propan-2-yl)ethanediamide
Chemical Structure Depiction of
N~1~-(4-methyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-6-yl)-N~2~-(propan-2-yl)ethanediamide
N~1~-(4-methyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-6-yl)-N~2~-(propan-2-yl)ethanediamide
Compound characteristics
| Compound ID: | IB07-9174 |
| Compound Name: | N~1~-(4-methyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-6-yl)-N~2~-(propan-2-yl)ethanediamide |
| Molecular Weight: | 291.3 |
| Molecular Formula: | C14 H17 N3 O4 |
| Smiles: | CC(C)NC(C(Nc1ccc2c(c1)N(C)C(CO2)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.23 |
| logD: | -0.97 |
| logSw: | -1.99 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 137.99 |
| InChI Key: | OPJKLUHRIURNNN-UHFFFAOYSA-N |