N-[(4-methoxyphenyl)methyl]-3,6-diphenyl-6,7-dihydro-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-7-carboxamide
Chemical Structure Depiction of
N-[(4-methoxyphenyl)methyl]-3,6-diphenyl-6,7-dihydro-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-7-carboxamide
N-[(4-methoxyphenyl)methyl]-3,6-diphenyl-6,7-dihydro-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-7-carboxamide
Compound characteristics
| Compound ID: | 7238-1559 |
| Compound Name: | N-[(4-methoxyphenyl)methyl]-3,6-diphenyl-6,7-dihydro-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-7-carboxamide |
| Molecular Weight: | 457.55 |
| Molecular Formula: | C25 H23 N5 O2 S |
| Smiles: | COc1ccc(CNC(C2C(c3ccccc3)Nn3c(c4ccccc4)nnc3S2)=O)cc1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.0363 |
| logD: | 4.0363 |
| logSw: | -4.1721 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 68.649 |
| InChI Key: | HKQJQPUTPMYBHZ-UHFFFAOYSA-N |