N-(3-bromophenyl)-4-[5-(phenylcarbamoyl)-1,3,4-thiadiazol-2-yl]piperidine-1-carboxamide
Chemical Structure Depiction of
N-(3-bromophenyl)-4-[5-(phenylcarbamoyl)-1,3,4-thiadiazol-2-yl]piperidine-1-carboxamide
N-(3-bromophenyl)-4-[5-(phenylcarbamoyl)-1,3,4-thiadiazol-2-yl]piperidine-1-carboxamide
Compound characteristics
Compound ID: | L077-0547 |
Compound Name: | N-(3-bromophenyl)-4-[5-(phenylcarbamoyl)-1,3,4-thiadiazol-2-yl]piperidine-1-carboxamide |
Molecular Weight: | 486.39 |
Molecular Formula: | C21 H20 Br N5 O2 S |
Smiles: | C1CN(CCC1c1nnc(C(Nc2ccccc2)=O)s1)C(Nc1cccc(c1)[Br])=O |
Stereo: | ACHIRAL |
logP: | 4.0908 |
logD: | 4.0907 |
logSw: | -4.1437 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 72.031 |
InChI Key: | FHIJYEOMXHTBDP-UHFFFAOYSA-N |