N-{2-ethyl-4-[2-(4-fluorophenyl)ethyl]-3-oxo-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}-N'-(3-methoxyphenyl)urea
Chemical Structure Depiction of
N-{2-ethyl-4-[2-(4-fluorophenyl)ethyl]-3-oxo-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}-N'-(3-methoxyphenyl)urea
N-{2-ethyl-4-[2-(4-fluorophenyl)ethyl]-3-oxo-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}-N'-(3-methoxyphenyl)urea
Compound characteristics
| Compound ID: | V016-8430 |
| Compound Name: | N-{2-ethyl-4-[2-(4-fluorophenyl)ethyl]-3-oxo-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}-N'-(3-methoxyphenyl)urea |
| Molecular Weight: | 477.54 |
| Molecular Formula: | C27 H28 F N3 O4 |
| Smiles: | CCC1C(N(CCc2ccc(cc2)F)Cc2cc(ccc2O1)NC(Nc1cccc(c1)OC)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.5645 |
| logD: | 5.5645 |
| logSw: | -5.4549 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 64.6 |
| InChI Key: | BOVDCAALYYKIMJ-DEOSSOPVSA-N |