N-(4-fluorophenyl)-5-({2-[(3-methylbutyl)amino]-2-oxoethoxy}methyl)-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
N-(4-fluorophenyl)-5-({2-[(3-methylbutyl)amino]-2-oxoethoxy}methyl)-1,3,4-thiadiazole-2-carboxamide
N-(4-fluorophenyl)-5-({2-[(3-methylbutyl)amino]-2-oxoethoxy}methyl)-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | F500-0640 |
| Compound Name: | N-(4-fluorophenyl)-5-({2-[(3-methylbutyl)amino]-2-oxoethoxy}methyl)-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 380.44 |
| Molecular Formula: | C17 H21 F N4 O3 S |
| Smiles: | CC(C)CCNC(COCc1nnc(C(Nc2ccc(cc2)F)=O)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1041 |
| logD: | 2.1014 |
| logSw: | -2.9221 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 80.076 |
| InChI Key: | CLDMJVFYHPRPKF-UHFFFAOYSA-N |