N-(3-chlorophenyl)-3-(phenoxymethyl)-6-phenyl-6,7-dihydro-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-7-carboxamide
Chemical Structure Depiction of
N-(3-chlorophenyl)-3-(phenoxymethyl)-6-phenyl-6,7-dihydro-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-7-carboxamide
N-(3-chlorophenyl)-3-(phenoxymethyl)-6-phenyl-6,7-dihydro-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-7-carboxamide
Compound characteristics
Compound ID: | D137-0594 |
Compound Name: | N-(3-chlorophenyl)-3-(phenoxymethyl)-6-phenyl-6,7-dihydro-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-7-carboxamide |
Molecular Weight: | 477.97 |
Molecular Formula: | C24 H20 Cl N5 O2 S |
Smiles: | C(c1nnc2n1NC(C(C(Nc1cccc(c1)[Cl])=O)S2)c1ccccc1)Oc1ccccc1 |
Stereo: | MIXTURE OF STEREOISOMERS |
logP: | 4.785 |
logD: | 4.7832 |
logSw: | -4.9643 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 68.258 |
InChI Key: | YADCHJKWOVTJRD-UHFFFAOYSA-N |