N-{4-[2-(2-methoxyphenyl)ethyl]-2-methyl-3-oxo-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}-2-(thiophen-2-yl)acetamide
Chemical Structure Depiction of
N-{4-[2-(2-methoxyphenyl)ethyl]-2-methyl-3-oxo-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}-2-(thiophen-2-yl)acetamide
N-{4-[2-(2-methoxyphenyl)ethyl]-2-methyl-3-oxo-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}-2-(thiophen-2-yl)acetamide
Compound characteristics
| Compound ID: | V023-5693 |
| Compound Name: | N-{4-[2-(2-methoxyphenyl)ethyl]-2-methyl-3-oxo-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}-2-(thiophen-2-yl)acetamide |
| Molecular Weight: | 450.56 |
| Molecular Formula: | C25 H26 N2 O4 S |
| Smiles: | CC1C(N(CCc2ccccc2OC)Cc2cc(ccc2O1)NC(Cc1cccs1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.6123 |
| logD: | 3.6123 |
| logSw: | -3.8461 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.086 |
| InChI Key: | MTSALLSNUMPNBQ-QGZVFWFLSA-N |