N-[2-(dimethylamino)ethyl]-4-{6-[(3-fluorophenoxy)acetyl]-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl}butanamide
Chemical Structure Depiction of
N-[2-(dimethylamino)ethyl]-4-{6-[(3-fluorophenoxy)acetyl]-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl}butanamide
N-[2-(dimethylamino)ethyl]-4-{6-[(3-fluorophenoxy)acetyl]-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl}butanamide
Compound characteristics
| Compound ID: | V023-3797 |
| Compound Name: | N-[2-(dimethylamino)ethyl]-4-{6-[(3-fluorophenoxy)acetyl]-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl}butanamide |
| Molecular Weight: | 457.5 |
| Molecular Formula: | C24 H28 F N3 O5 |
| Smiles: | CN(C)CCNC(CCCN1C(COc2ccc(cc12)C(COc1cccc(c1)F)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.9613 |
| logD: | -0.5843 |
| logSw: | -2.0863 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.971 |
| InChI Key: | VDUJNPDFFXGGEG-UHFFFAOYSA-N |