N-(3-chlorophenyl)-5-({2-[(3-methylbutyl)amino]-2-oxoethoxy}methyl)-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
N-(3-chlorophenyl)-5-({2-[(3-methylbutyl)amino]-2-oxoethoxy}methyl)-1,3,4-thiadiazole-2-carboxamide
N-(3-chlorophenyl)-5-({2-[(3-methylbutyl)amino]-2-oxoethoxy}methyl)-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | F500-0456 |
| Compound Name: | N-(3-chlorophenyl)-5-({2-[(3-methylbutyl)amino]-2-oxoethoxy}methyl)-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 396.89 |
| Molecular Formula: | C17 H21 Cl N4 O3 S |
| Smiles: | CC(C)CCNC(COCc1nnc(C(Nc2cccc(c2)[Cl])=O)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8286 |
| logD: | 2.8253 |
| logSw: | -3.5433 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 80.076 |
| InChI Key: | TWJYGNKQWHVDTR-UHFFFAOYSA-N |