2-{N-[(adamantan-1-yl)methyl]-4-methylbenzamido}ethyl 4-methylbenzoate
Chemical Structure Depiction of
2-{N-[(adamantan-1-yl)methyl]-4-methylbenzamido}ethyl 4-methylbenzoate
2-{N-[(adamantan-1-yl)methyl]-4-methylbenzamido}ethyl 4-methylbenzoate
Compound characteristics
| Compound ID: | 8017-5497 |
| Compound Name: | 2-{N-[(adamantan-1-yl)methyl]-4-methylbenzamido}ethyl 4-methylbenzoate |
| Molecular Weight: | 445.6 |
| Molecular Formula: | C29 H35 N O3 |
| Smiles: | Cc1ccc(cc1)C(N(CCOC(c1ccc(C)cc1)=O)CC12CC3CC(CC(C3)C2)C1)=O |
| Stereo: | ACHIRAL |
| logP: | 7.1476 |
| logD: | 7.1476 |
| logSw: | -5.751 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 37.237 |
| InChI Key: | MIDZZLUKJRTWIJ-UHFFFAOYSA-N |