N-[3-(1,3-benzothiazol-2-yl)-2-methylphenyl]adamantane-1-carboxamide
Chemical Structure Depiction of
N-[3-(1,3-benzothiazol-2-yl)-2-methylphenyl]adamantane-1-carboxamide
N-[3-(1,3-benzothiazol-2-yl)-2-methylphenyl]adamantane-1-carboxamide
Compound characteristics
| Compound ID: | D344-4139 |
| Compound Name: | N-[3-(1,3-benzothiazol-2-yl)-2-methylphenyl]adamantane-1-carboxamide |
| Molecular Weight: | 402.56 |
| Molecular Formula: | C25 H26 N2 O S |
| Smiles: | [H][C@@]12CC3(C[C@@]([H])(C1)C[C@]([H])(C3)C2)C(Nc1cccc(c1C)c1nc2ccccc2s1)=O |
| Stereo: | ACHIRAL |
| logP: | 7.0443 |
| logD: | 7.0443 |
| logSw: | -5.8797 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 32.114 |
| InChI Key: | DBYNTYYLMPDNQP-UHFFFAOYSA-N |