6-(3-chloro-4-methoxyphenyl)-N-(4-methoxyphenyl)-3-propyl-6,7-dihydro-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-7-carboxamide
Chemical Structure Depiction of
6-(3-chloro-4-methoxyphenyl)-N-(4-methoxyphenyl)-3-propyl-6,7-dihydro-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-7-carboxamide
6-(3-chloro-4-methoxyphenyl)-N-(4-methoxyphenyl)-3-propyl-6,7-dihydro-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-7-carboxamide
Compound characteristics
| Compound ID: | D137-0582 |
| Compound Name: | 6-(3-chloro-4-methoxyphenyl)-N-(4-methoxyphenyl)-3-propyl-6,7-dihydro-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-7-carboxamide |
| Molecular Weight: | 473.98 |
| Molecular Formula: | C22 H24 Cl N5 O3 S |
| Smiles: | CCCc1nnc2n1NC(C(C(Nc1ccc(cc1)OC)=O)S2)c1ccc(c(c1)[Cl])OC |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.2342 |
| logD: | 4.2341 |
| logSw: | -4.7174 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 76.205 |
| InChI Key: | JJMSQPZPGFOYHL-UHFFFAOYSA-N |