4-acetamido-5-chloro-2-methoxy-N-[5-(3-phenylpropyl)-1,3,4-thiadiazol-2-yl]benzamide
Chemical Structure Depiction of
4-acetamido-5-chloro-2-methoxy-N-[5-(3-phenylpropyl)-1,3,4-thiadiazol-2-yl]benzamide
4-acetamido-5-chloro-2-methoxy-N-[5-(3-phenylpropyl)-1,3,4-thiadiazol-2-yl]benzamide
Compound characteristics
Compound ID: | Y031-3470 |
Compound Name: | 4-acetamido-5-chloro-2-methoxy-N-[5-(3-phenylpropyl)-1,3,4-thiadiazol-2-yl]benzamide |
Molecular Weight: | 444.94 |
Molecular Formula: | C21 H21 Cl N4 O3 S |
Smiles: | CC(Nc1cc(c(cc1[Cl])C(Nc1nnc(CCCc2ccccc2)s1)=O)OC)=O |
Stereo: | ACHIRAL |
logP: | 5.0264 |
logD: | 1.9931 |
logSw: | -5.1768 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 77.293 |
InChI Key: | SCFFAIQSJOQDFE-UHFFFAOYSA-N |