N-(3-oxo-2,5,6,7,8,9-hexahydro-3H-[1,2,4]triazolo[4,3-a]azepin-7-yl)-1,3-thiazole-4-carboxamide
Chemical Structure Depiction of
N-(3-oxo-2,5,6,7,8,9-hexahydro-3H-[1,2,4]triazolo[4,3-a]azepin-7-yl)-1,3-thiazole-4-carboxamide
N-(3-oxo-2,5,6,7,8,9-hexahydro-3H-[1,2,4]triazolo[4,3-a]azepin-7-yl)-1,3-thiazole-4-carboxamide
Compound characteristics
| Compound ID: | S638-4483 |
| Compound Name: | N-(3-oxo-2,5,6,7,8,9-hexahydro-3H-[1,2,4]triazolo[4,3-a]azepin-7-yl)-1,3-thiazole-4-carboxamide |
| Molecular Weight: | 279.32 |
| Molecular Formula: | C11 H13 N5 O2 S |
| Smiles: | C1CC2=NNC(N2CCC1NC(c1cscn1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.62 |
| logD: | 0.6135 |
| logSw: | -2.0176 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 75.692 |
| InChI Key: | OSRZOQSHMLMDEF-ZETCQYMHSA-N |