N-methyl-N-(2-methyl-3-oxo-2,5,6,7,8,9-hexahydro-3H-[1,2,4]triazolo[4,3-a]azepin-7-yl)-2-(2-oxo-1,3-benzoxazol-3(2H)-yl)acetamide
Chemical Structure Depiction of
N-methyl-N-(2-methyl-3-oxo-2,5,6,7,8,9-hexahydro-3H-[1,2,4]triazolo[4,3-a]azepin-7-yl)-2-(2-oxo-1,3-benzoxazol-3(2H)-yl)acetamide
N-methyl-N-(2-methyl-3-oxo-2,5,6,7,8,9-hexahydro-3H-[1,2,4]triazolo[4,3-a]azepin-7-yl)-2-(2-oxo-1,3-benzoxazol-3(2H)-yl)acetamide
Compound characteristics
| Compound ID: | S638-2163 |
| Compound Name: | N-methyl-N-(2-methyl-3-oxo-2,5,6,7,8,9-hexahydro-3H-[1,2,4]triazolo[4,3-a]azepin-7-yl)-2-(2-oxo-1,3-benzoxazol-3(2H)-yl)acetamide |
| Molecular Weight: | 371.39 |
| Molecular Formula: | C18 H21 N5 O4 |
| Smiles: | CN(C1CCC2=NN(C)C(N2CC1)=O)C(CN1C(=O)Oc2ccccc12)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.8505 |
| logD: | 0.8505 |
| logSw: | -1.3563 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 71.049 |
| InChI Key: | CWYGUMGSAPGQSM-LBPRGKRZSA-N |