N-[(2-ethoxyphenyl)methyl]-5-(pyrido[2,3-b][1,4]benzoxazepin-5(6H)-yl)thiophene-2-carboxamide
Chemical Structure Depiction of
N-[(2-ethoxyphenyl)methyl]-5-(pyrido[2,3-b][1,4]benzoxazepin-5(6H)-yl)thiophene-2-carboxamide
N-[(2-ethoxyphenyl)methyl]-5-(pyrido[2,3-b][1,4]benzoxazepin-5(6H)-yl)thiophene-2-carboxamide
Compound characteristics
| Compound ID: | G121-0163 |
| Compound Name: | N-[(2-ethoxyphenyl)methyl]-5-(pyrido[2,3-b][1,4]benzoxazepin-5(6H)-yl)thiophene-2-carboxamide |
| Molecular Weight: | 457.55 |
| Molecular Formula: | C26 H23 N3 O3 S |
| Smiles: | CCOc1ccccc1CNC(c1ccc(N2Cc3ccccc3Oc3c2cccn3)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.8999 |
| logD: | 5.8998 |
| logSw: | -5.4691 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.473 |
| InChI Key: | OSEFVNKYSHTBIC-UHFFFAOYSA-N |