N,N-diethyl-3-oxo-4-{2-oxo-2-[4-(pyrimidin-2-yl)piperazin-1-yl]ethyl}-3,4-dihydro-2H-1,4-benzoxazine-6-carboxamide
Chemical Structure Depiction of
N,N-diethyl-3-oxo-4-{2-oxo-2-[4-(pyrimidin-2-yl)piperazin-1-yl]ethyl}-3,4-dihydro-2H-1,4-benzoxazine-6-carboxamide
N,N-diethyl-3-oxo-4-{2-oxo-2-[4-(pyrimidin-2-yl)piperazin-1-yl]ethyl}-3,4-dihydro-2H-1,4-benzoxazine-6-carboxamide
Compound characteristics
| Compound ID: | F118-0695 |
| Compound Name: | N,N-diethyl-3-oxo-4-{2-oxo-2-[4-(pyrimidin-2-yl)piperazin-1-yl]ethyl}-3,4-dihydro-2H-1,4-benzoxazine-6-carboxamide |
| Molecular Weight: | 452.51 |
| Molecular Formula: | C23 H28 N6 O4 |
| Smiles: | CCN(CC)C(c1ccc2c(c1)N(CC(N1CCN(CC1)c1ncccn1)=O)C(CO2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.4621 |
| logD: | 0.4621 |
| logSw: | -1.6435 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 78.015 |
| InChI Key: | IAYALYMIMFJFGW-UHFFFAOYSA-N |