N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(4-methylphenyl)-7,8-dihydro[1,2,4]triazolo[5',1':2,3][1,3]thiazolo[5,4-c]pyridine-6(5H)-carboxamide
Chemical Structure Depiction of
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(4-methylphenyl)-7,8-dihydro[1,2,4]triazolo[5',1':2,3][1,3]thiazolo[5,4-c]pyridine-6(5H)-carboxamide
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(4-methylphenyl)-7,8-dihydro[1,2,4]triazolo[5',1':2,3][1,3]thiazolo[5,4-c]pyridine-6(5H)-carboxamide
Compound characteristics
| Compound ID: | F924-0420 |
| Compound Name: | N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(4-methylphenyl)-7,8-dihydro[1,2,4]triazolo[5',1':2,3][1,3]thiazolo[5,4-c]pyridine-6(5H)-carboxamide |
| Molecular Weight: | 447.51 |
| Molecular Formula: | C23 H21 N5 O3 S |
| Smiles: | Cc1ccc(cc1)c1nc2n(C3CCN(CC=3S2)C(Nc2ccc3c(c2)OCCO3)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 3.4582 |
| logD: | 3.4582 |
| logSw: | -3.7336 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.048 |
| InChI Key: | PQCQWKOLEOJUQQ-UHFFFAOYSA-N |