N-[(2-fluorophenyl)methyl]-4-[(thiophen-2-yl)acetyl]-2,3,4,5-tetrahydro-1,4-benzoxazepine-7-carboxamide
Chemical Structure Depiction of
N-[(2-fluorophenyl)methyl]-4-[(thiophen-2-yl)acetyl]-2,3,4,5-tetrahydro-1,4-benzoxazepine-7-carboxamide
N-[(2-fluorophenyl)methyl]-4-[(thiophen-2-yl)acetyl]-2,3,4,5-tetrahydro-1,4-benzoxazepine-7-carboxamide
Compound characteristics
| Compound ID: | M248-0238 |
| Compound Name: | N-[(2-fluorophenyl)methyl]-4-[(thiophen-2-yl)acetyl]-2,3,4,5-tetrahydro-1,4-benzoxazepine-7-carboxamide |
| Molecular Weight: | 424.49 |
| Molecular Formula: | C23 H21 F N2 O3 S |
| Smiles: | C(C(N1CCOc2ccc(cc2C1)C(NCc1ccccc1F)=O)=O)c1cccs1 |
| Stereo: | ACHIRAL |
| logP: | 3.737 |
| logD: | 3.737 |
| logSw: | -4.1095 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.735 |
| InChI Key: | RXWKLAQKEMEVFW-UHFFFAOYSA-N |