ethyl 3-({5-[benzyl(methyl)amino]-1,3,4-thiadiazol-2-yl}carbamamido)-3-phenylpropanoate
Chemical Structure Depiction of
ethyl 3-({5-[benzyl(methyl)amino]-1,3,4-thiadiazol-2-yl}carbamamido)-3-phenylpropanoate
ethyl 3-({5-[benzyl(methyl)amino]-1,3,4-thiadiazol-2-yl}carbamamido)-3-phenylpropanoate
Compound characteristics
| Compound ID: | E002-1508 |
| Compound Name: | ethyl 3-({5-[benzyl(methyl)amino]-1,3,4-thiadiazol-2-yl}carbamamido)-3-phenylpropanoate |
| Molecular Weight: | 439.54 |
| Molecular Formula: | C22 H25 N5 O3 S |
| Smiles: | CCOC(CC(c1ccccc1)NC(Nc1nnc(N(C)Cc2ccccc2)s1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.1965 |
| logD: | 4.1965 |
| logSw: | -4.0626 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 79.967 |
| InChI Key: | BWFQSJKAYQWYSN-SFHVURJKSA-N |