ethyl 4-({5-[cyclohexyl(methyl)amino]-1,3,4-thiadiazol-2-yl}carbamamido)benzoate
Chemical Structure Depiction of
ethyl 4-({5-[cyclohexyl(methyl)amino]-1,3,4-thiadiazol-2-yl}carbamamido)benzoate
ethyl 4-({5-[cyclohexyl(methyl)amino]-1,3,4-thiadiazol-2-yl}carbamamido)benzoate
Compound characteristics
| Compound ID: | E002-1844 |
| Compound Name: | ethyl 4-({5-[cyclohexyl(methyl)amino]-1,3,4-thiadiazol-2-yl}carbamamido)benzoate |
| Molecular Weight: | 403.5 |
| Molecular Formula: | C19 H25 N5 O3 S |
| Smiles: | CCOC(c1ccc(cc1)NC(Nc1nnc(N(C)C2CCCCC2)s1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0509 |
| logD: | 5.0509 |
| logSw: | -4.4125 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 78.661 |
| InChI Key: | SMYHVNOCBLDFRW-UHFFFAOYSA-N |