N-{3'-acetyl-5-bromo-1-[(4-methylphenyl)methyl]-2-oxo-1,2-dihydro-3'H-spiro[indole-3,2'-[1,3,4]thiadiazol]-5'-yl}acetamide
Chemical Structure Depiction of
N-{3'-acetyl-5-bromo-1-[(4-methylphenyl)methyl]-2-oxo-1,2-dihydro-3'H-spiro[indole-3,2'-[1,3,4]thiadiazol]-5'-yl}acetamide
N-{3'-acetyl-5-bromo-1-[(4-methylphenyl)methyl]-2-oxo-1,2-dihydro-3'H-spiro[indole-3,2'-[1,3,4]thiadiazol]-5'-yl}acetamide
Compound characteristics
| Compound ID: | D436-0687 |
| Compound Name: | N-{3'-acetyl-5-bromo-1-[(4-methylphenyl)methyl]-2-oxo-1,2-dihydro-3'H-spiro[indole-3,2'-[1,3,4]thiadiazol]-5'-yl}acetamide |
| Molecular Weight: | 487.37 |
| Molecular Formula: | C21 H19 Br N4 O3 S |
| Smiles: | CC(NC1=NN(C(C)=O)C2(C(N(Cc3ccc(C)cc3)c3ccc(cc23)[Br])=O)S1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.9181 |
| logD: | 3.903 |
| logSw: | -3.9438 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.045 |
| InChI Key: | GCJIMLHJJLCMIS-NRFANRHFSA-N |