N-{5-[(4-tert-butylphenoxy)methyl]-1,3,4-thiadiazol-2-yl}-4-chlorobenzamide
Chemical Structure Depiction of
N-{5-[(4-tert-butylphenoxy)methyl]-1,3,4-thiadiazol-2-yl}-4-chlorobenzamide
N-{5-[(4-tert-butylphenoxy)methyl]-1,3,4-thiadiazol-2-yl}-4-chlorobenzamide
Compound characteristics
| Compound ID: | 8009-4009 |
| Compound Name: | N-{5-[(4-tert-butylphenoxy)methyl]-1,3,4-thiadiazol-2-yl}-4-chlorobenzamide |
| Molecular Weight: | 401.91 |
| Molecular Formula: | C20 H20 Cl N3 O2 S |
| Smiles: | CC(C)(C)c1ccc(cc1)OCc1nnc(NC(c2ccc(cc2)[Cl])=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 5.9368 |
| logD: | 4.0527 |
| logSw: | -6.2024 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.597 |
| InChI Key: | BAZJPAWOUMWIMH-UHFFFAOYSA-N |