N-{4-acetyl-5-[3-chloro-5-methoxy-4-(2-phenoxyethoxy)phenyl]-4,5-dihydro-1,3,4-thiadiazol-2-yl}acetamide
Chemical Structure Depiction of
N-{4-acetyl-5-[3-chloro-5-methoxy-4-(2-phenoxyethoxy)phenyl]-4,5-dihydro-1,3,4-thiadiazol-2-yl}acetamide
N-{4-acetyl-5-[3-chloro-5-methoxy-4-(2-phenoxyethoxy)phenyl]-4,5-dihydro-1,3,4-thiadiazol-2-yl}acetamide
Compound characteristics
| Compound ID: | D336-6253 |
| Compound Name: | N-{4-acetyl-5-[3-chloro-5-methoxy-4-(2-phenoxyethoxy)phenyl]-4,5-dihydro-1,3,4-thiadiazol-2-yl}acetamide |
| Molecular Weight: | 463.94 |
| Molecular Formula: | C21 H22 Cl N3 O5 S |
| Smiles: | CC(NC1=NN(C(c2cc(c(c(c2)[Cl])OCCOc2ccccc2)OC)S1)C(C)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.7113 |
| logD: | 3.6649 |
| logSw: | -4.1328 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.51 |
| InChI Key: | DKPIBVSTBGYWKN-FQEVSTJZSA-N |