N-[5-(adamantan-1-yl)-1,3,4-thiadiazol-2-yl]-3-chlorobenzamide
Chemical Structure Depiction of
N-[5-(adamantan-1-yl)-1,3,4-thiadiazol-2-yl]-3-chlorobenzamide
N-[5-(adamantan-1-yl)-1,3,4-thiadiazol-2-yl]-3-chlorobenzamide
Compound characteristics
| Compound ID: | 3086-0065 |
| Compound Name: | N-[5-(adamantan-1-yl)-1,3,4-thiadiazol-2-yl]-3-chlorobenzamide |
| Molecular Weight: | 373.9 |
| Molecular Formula: | C19 H20 Cl N3 O S |
| Smiles: | C1C2CC3CC1CC(C2)(C3)c1nnc(NC(c2cccc(c2)[Cl])=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 6.0857 |
| logD: | 4.5633 |
| logSw: | -6.3892 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.636 |
| InChI Key: | YPVFAINEBNGSSX-UHFFFAOYSA-N |