N-[2-(cyclopropylmethyl)-3-oxo-2,5,6,7,8,9-hexahydro-3H-[1,2,4]triazolo[4,3-a]azepin-7-yl]-N,3,5-trimethyl-1,2-oxazole-4-sulfonamide
Chemical Structure Depiction of
N-[2-(cyclopropylmethyl)-3-oxo-2,5,6,7,8,9-hexahydro-3H-[1,2,4]triazolo[4,3-a]azepin-7-yl]-N,3,5-trimethyl-1,2-oxazole-4-sulfonamide
N-[2-(cyclopropylmethyl)-3-oxo-2,5,6,7,8,9-hexahydro-3H-[1,2,4]triazolo[4,3-a]azepin-7-yl]-N,3,5-trimethyl-1,2-oxazole-4-sulfonamide
Compound characteristics
| Compound ID: | S638-2818 |
| Compound Name: | N-[2-(cyclopropylmethyl)-3-oxo-2,5,6,7,8,9-hexahydro-3H-[1,2,4]triazolo[4,3-a]azepin-7-yl]-N,3,5-trimethyl-1,2-oxazole-4-sulfonamide |
| Molecular Weight: | 395.48 |
| Molecular Formula: | C17 H25 N5 O4 S |
| Smiles: | Cc1c(c(C)on1)S(N(C)C1CCC2=NN(CC3CC3)C(N2CC1)=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.5161 |
| logD: | 1.5124 |
| logSw: | -1.9123 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 88.539 |
| InChI Key: | OLJRLMVHFNAQBL-AWEZNQCLSA-N |