2-(diethylamino)ethyl 4-[(5,6,7,8-tetrahydro-4H-cyclohepta[d][1,2]oxazole-3-carbonyl)amino]benzoate
Chemical Structure Depiction of
2-(diethylamino)ethyl 4-[(5,6,7,8-tetrahydro-4H-cyclohepta[d][1,2]oxazole-3-carbonyl)amino]benzoate
2-(diethylamino)ethyl 4-[(5,6,7,8-tetrahydro-4H-cyclohepta[d][1,2]oxazole-3-carbonyl)amino]benzoate
Compound characteristics
| Compound ID: | E920-0107 |
| Compound Name: | 2-(diethylamino)ethyl 4-[(5,6,7,8-tetrahydro-4H-cyclohepta[d][1,2]oxazole-3-carbonyl)amino]benzoate |
| Molecular Weight: | 399.49 |
| Molecular Formula: | C22 H29 N3 O4 |
| Smiles: | CCN(CC)CCOC(c1ccc(cc1)NC(c1c2CCCCCc2on1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.252 |
| logD: | 3.2837 |
| logSw: | -4.0139 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.52 |
| InChI Key: | WOFSLFNSHVLIHH-UHFFFAOYSA-N |