ethyl 4-{[3-(5-methyl-2H-tetrazol-2-yl)tricyclo[3.3.1.1~3,7~]decane-1-carbonyl]amino}benzoate
Chemical Structure Depiction of
ethyl 4-{[3-(5-methyl-2H-tetrazol-2-yl)tricyclo[3.3.1.1~3,7~]decane-1-carbonyl]amino}benzoate
ethyl 4-{[3-(5-methyl-2H-tetrazol-2-yl)tricyclo[3.3.1.1~3,7~]decane-1-carbonyl]amino}benzoate
Compound characteristics
| Compound ID: | C301-3275 |
| Compound Name: | ethyl 4-{[3-(5-methyl-2H-tetrazol-2-yl)tricyclo[3.3.1.1~3,7~]decane-1-carbonyl]amino}benzoate |
| Molecular Weight: | 409.49 |
| Molecular Formula: | C22 H27 N5 O3 |
| Smiles: | CCOC(c1ccc(cc1)NC(C12CC3CC(C1)CC(C3)(C2)n1nc(C)nn1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0973 |
| logD: | 4.0961 |
| logSw: | -4.1415 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.292 |
| InChI Key: | BDOJLQQDHLPITF-UHFFFAOYSA-N |