N-[5-(adamantan-1-yl)-1,3,4-thiadiazol-2-yl]-3-(trifluoromethyl)benzamide
Chemical Structure Depiction of
N-[5-(adamantan-1-yl)-1,3,4-thiadiazol-2-yl]-3-(trifluoromethyl)benzamide
N-[5-(adamantan-1-yl)-1,3,4-thiadiazol-2-yl]-3-(trifluoromethyl)benzamide
Compound characteristics
| Compound ID: | 2513-1976 |
| Compound Name: | N-[5-(adamantan-1-yl)-1,3,4-thiadiazol-2-yl]-3-(trifluoromethyl)benzamide |
| Molecular Weight: | 407.46 |
| Molecular Formula: | C20 H20 F3 N3 O S |
| Smiles: | C1C2CC3CC1CC(C2)(C3)c1nnc(NC(c2cccc(c2)C(F)(F)F)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 6.2263 |
| logD: | 5.0479 |
| logSw: | -6.251 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.636 |
| InChI Key: | HXHDEJRDEHBKTN-UHFFFAOYSA-N |