ethyl (4-{[2-(5-methylthiophen-2-yl)azepane-1-carbonyl]amino}phenyl)acetate
Chemical Structure Depiction of
ethyl (4-{[2-(5-methylthiophen-2-yl)azepane-1-carbonyl]amino}phenyl)acetate
ethyl (4-{[2-(5-methylthiophen-2-yl)azepane-1-carbonyl]amino}phenyl)acetate
Compound characteristics
| Compound ID: | J007-0602 |
| Compound Name: | ethyl (4-{[2-(5-methylthiophen-2-yl)azepane-1-carbonyl]amino}phenyl)acetate |
| Molecular Weight: | 400.54 |
| Molecular Formula: | C22 H28 N2 O3 S |
| Smiles: | CCOC(Cc1ccc(cc1)NC(N1CCCCCC1c1ccc(C)s1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.896 |
| logD: | 4.896 |
| logSw: | -4.3346 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.638 |
| InChI Key: | UQALRSVZRQYBHR-IBGZPJMESA-N |