3-(3,5-dimethyl-1H-pyrazol-1-yl)-1-[(3S)-3-methyl-7-(morpholine-4-carbonyl)-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl]propan-1-one
Chemical Structure Depiction of
3-(3,5-dimethyl-1H-pyrazol-1-yl)-1-[(3S)-3-methyl-7-(morpholine-4-carbonyl)-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl]propan-1-one
3-(3,5-dimethyl-1H-pyrazol-1-yl)-1-[(3S)-3-methyl-7-(morpholine-4-carbonyl)-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl]propan-1-one
Compound characteristics
| Compound ID: | S979-0488 |
| Compound Name: | 3-(3,5-dimethyl-1H-pyrazol-1-yl)-1-[(3S)-3-methyl-7-(morpholine-4-carbonyl)-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl]propan-1-one |
| Molecular Weight: | 426.51 |
| Molecular Formula: | C23 H30 N4 O4 |
| Smiles: | Cc1cc(C)n(CCC(N2Cc3cc(ccc3OC[C@@H]2C)C(N2CCOCC2)=O)=O)n1 |
| Stereo: | ABSOLUTE |
| logP: | 0.8386 |
| logD: | 0.8384 |
| logSw: | -1.721 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 62.629 |
| InChI Key: | VFWBEDBUCZXGLD-GOSISDBHSA-N |