4-[2-(3-chloro-4-methoxyanilino)-2-oxoethyl]-N,N-diethyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-carboxamide
Chemical Structure Depiction of
4-[2-(3-chloro-4-methoxyanilino)-2-oxoethyl]-N,N-diethyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-carboxamide
4-[2-(3-chloro-4-methoxyanilino)-2-oxoethyl]-N,N-diethyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-carboxamide
Compound characteristics
| Compound ID: | F118-0702 |
| Compound Name: | 4-[2-(3-chloro-4-methoxyanilino)-2-oxoethyl]-N,N-diethyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-carboxamide |
| Molecular Weight: | 445.9 |
| Molecular Formula: | C22 H24 Cl N3 O5 |
| Smiles: | CCN(CC)C(c1ccc2c(c1)N(CC(Nc1ccc(c(c1)[Cl])OC)=O)C(CO2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2444 |
| logD: | 2.2439 |
| logSw: | -3.3799 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.78 |
| InChI Key: | BOVMMUMESAFKJK-UHFFFAOYSA-N |