N-{5-[(2-methylprop-2-en-1-yl)sulfanyl]-1,3,4-thiadiazol-2-yl}-3-phenylpropanamide
Chemical Structure Depiction of
N-{5-[(2-methylprop-2-en-1-yl)sulfanyl]-1,3,4-thiadiazol-2-yl}-3-phenylpropanamide
N-{5-[(2-methylprop-2-en-1-yl)sulfanyl]-1,3,4-thiadiazol-2-yl}-3-phenylpropanamide
Compound characteristics
| Compound ID: | V028-6591 |
| Compound Name: | N-{5-[(2-methylprop-2-en-1-yl)sulfanyl]-1,3,4-thiadiazol-2-yl}-3-phenylpropanamide |
| Molecular Weight: | 319.45 |
| Molecular Formula: | C15 H17 N3 O S2 |
| Smiles: | CC(=C)CSc1nnc(NC(CCc2ccccc2)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 4.4419 |
| logD: | 4.436 |
| logSw: | -4.3228 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.022 |
| InChI Key: | YFHSNHQCQZDDQN-UHFFFAOYSA-N |