methyl 2-[(6-chloro-2,3-dihydro-4H-1,4-benzoxazine-4-carbonyl)amino]benzoate
Chemical Structure Depiction of
methyl 2-[(6-chloro-2,3-dihydro-4H-1,4-benzoxazine-4-carbonyl)amino]benzoate
methyl 2-[(6-chloro-2,3-dihydro-4H-1,4-benzoxazine-4-carbonyl)amino]benzoate
Compound characteristics
| Compound ID: | E216-5073 |
| Compound Name: | methyl 2-[(6-chloro-2,3-dihydro-4H-1,4-benzoxazine-4-carbonyl)amino]benzoate |
| Molecular Weight: | 346.77 |
| Molecular Formula: | C17 H15 Cl N2 O4 |
| Smiles: | COC(c1ccccc1NC(N1CCOc2ccc(cc12)[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9105 |
| logD: | 3.9078 |
| logSw: | -4.2835 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.799 |
| InChI Key: | ZZIHAPGMTHASQX-UHFFFAOYSA-N |