N-{4-acetyl-5-[3-chloro-4-(3-phenoxypropoxy)phenyl]-4,5-dihydro-1,3,4-thiadiazol-2-yl}acetamide
Chemical Structure Depiction of
N-{4-acetyl-5-[3-chloro-4-(3-phenoxypropoxy)phenyl]-4,5-dihydro-1,3,4-thiadiazol-2-yl}acetamide
N-{4-acetyl-5-[3-chloro-4-(3-phenoxypropoxy)phenyl]-4,5-dihydro-1,3,4-thiadiazol-2-yl}acetamide
Compound characteristics
| Compound ID: | D336-7207 |
| Compound Name: | N-{4-acetyl-5-[3-chloro-4-(3-phenoxypropoxy)phenyl]-4,5-dihydro-1,3,4-thiadiazol-2-yl}acetamide |
| Molecular Weight: | 447.94 |
| Molecular Formula: | C21 H22 Cl N3 O4 S |
| Smiles: | CC(NC1=NN(C(c2ccc(c(c2)[Cl])OCCCOc2ccccc2)S1)C(C)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.1776 |
| logD: | 4.1312 |
| logSw: | -4.6163 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.793 |
| InChI Key: | LROCCAKLDYNEGH-FQEVSTJZSA-N |