ethyl 4-({5-[bis(2-methylpropyl)amino]-1,3,4-thiadiazol-2-yl}carbamamido)benzoate
Chemical Structure Depiction of
ethyl 4-({5-[bis(2-methylpropyl)amino]-1,3,4-thiadiazol-2-yl}carbamamido)benzoate
ethyl 4-({5-[bis(2-methylpropyl)amino]-1,3,4-thiadiazol-2-yl}carbamamido)benzoate
Compound characteristics
| Compound ID: | E002-1804 |
| Compound Name: | ethyl 4-({5-[bis(2-methylpropyl)amino]-1,3,4-thiadiazol-2-yl}carbamamido)benzoate |
| Molecular Weight: | 419.54 |
| Molecular Formula: | C20 H29 N5 O3 S |
| Smiles: | CCOC(c1ccc(cc1)NC(Nc1nnc(N(CC(C)C)CC(C)C)s1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.9793 |
| logD: | 5.9793 |
| logSw: | -5.5241 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 79.942 |
| InChI Key: | ZVFOOLBNARVBOJ-UHFFFAOYSA-N |