N-[2-(cyclopropylmethyl)-3-oxo-2,5,6,7,8,9-hexahydro-3H-[1,2,4]triazolo[4,3-a]azepin-7-yl]-3-(3,5-dimethyl-1,2-oxazol-4-yl)propanamide
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]-3-(3,5-dimethyl-1,2-oxazol-4-yl)propanamide
N-[2-(cyclopropylmethyl)-3-oxo-2,5,6,7,8,9-hexahydro-3H-[1,2,4]triazolo[4,3-a]azepin-7-yl]-3-(3,5-dimethyl-1,2-oxazol-4-yl)propanamide
Compound characteristics
| Compound ID: | S638-4641 |
| 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]-3-(3,5-dimethyl-1,2-oxazol-4-yl)propanamide |
| Molecular Weight: | 373.45 |
| Molecular Formula: | C19 H27 N5 O3 |
| Smiles: | Cc1c(CCC(NC2CCC3=NN(CC4CC4)C(N3CC2)=O)=O)c(C)on1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.7069 |
| logD: | 1.7009 |
| logSw: | -1.9517 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.81 |
| InChI Key: | BLRBKLRHBXRVFA-HNNXBMFYSA-N |