5-{[2-(butylamino)-2-oxoethoxy]methyl}-N-(3-chlorophenyl)-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
5-{[2-(butylamino)-2-oxoethoxy]methyl}-N-(3-chlorophenyl)-1,3,4-thiadiazole-2-carboxamide
5-{[2-(butylamino)-2-oxoethoxy]methyl}-N-(3-chlorophenyl)-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | F500-0516 |
| Compound Name: | 5-{[2-(butylamino)-2-oxoethoxy]methyl}-N-(3-chlorophenyl)-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 382.87 |
| Molecular Formula: | C16 H19 Cl N4 O3 S |
| Smiles: | CCCCNC(COCc1nnc(C(Nc2cccc(c2)[Cl])=O)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6147 |
| logD: | 2.6114 |
| logSw: | -3.4477 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 80.076 |
| InChI Key: | AWTJXHZEPAOYOK-UHFFFAOYSA-N |