N-[2-(cyclopropylmethyl)-3-oxo-2,5,6,7,8,9-hexahydro-3H-[1,2,4]triazolo[4,3-a]azepin-7-yl]-N,5-dimethylthiophene-2-carboxamide
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,5-dimethylthiophene-2-carboxamide
N-[2-(cyclopropylmethyl)-3-oxo-2,5,6,7,8,9-hexahydro-3H-[1,2,4]triazolo[4,3-a]azepin-7-yl]-N,5-dimethylthiophene-2-carboxamide
Compound characteristics
| Compound ID: | S638-2541 |
| 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,5-dimethylthiophene-2-carboxamide |
| Molecular Weight: | 360.48 |
| Molecular Formula: | C18 H24 N4 O2 S |
| Smiles: | Cc1ccc(C(N(C)C2CCC3=NN(CC4CC4)C(N3CC2)=O)=O)s1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.0583 |
| logD: | 3.0523 |
| logSw: | -3.1064 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 50.067 |
| InChI Key: | UUCYUULVVVEVMA-AWEZNQCLSA-N |