N-{4-[(3-methylbutyl)carbamoyl]phenyl}-5-(phenoxymethyl)-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
N-{4-[(3-methylbutyl)carbamoyl]phenyl}-5-(phenoxymethyl)-1,3,4-thiadiazole-2-carboxamide
N-{4-[(3-methylbutyl)carbamoyl]phenyl}-5-(phenoxymethyl)-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | F913-0177 |
| Compound Name: | N-{4-[(3-methylbutyl)carbamoyl]phenyl}-5-(phenoxymethyl)-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 424.52 |
| Molecular Formula: | C22 H24 N4 O3 S |
| Smiles: | CC(C)CCNC(c1ccc(cc1)NC(c1nnc(COc2ccccc2)s1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7744 |
| logD: | 3.7677 |
| logSw: | -3.9791 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 79.083 |
| InChI Key: | RHLZJZFYPCMRRC-UHFFFAOYSA-N |