N-[2-(cyclopropylmethyl)-3-oxo-2,5,6,7,8,9-hexahydro-3H-[1,2,4]triazolo[4,3-a]azepin-7-yl]-6-hydroxypyridine-3-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]-6-hydroxypyridine-3-carboxamide
N-[2-(cyclopropylmethyl)-3-oxo-2,5,6,7,8,9-hexahydro-3H-[1,2,4]triazolo[4,3-a]azepin-7-yl]-6-hydroxypyridine-3-carboxamide
Compound characteristics
| Compound ID: | S638-1059 |
| 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]-6-hydroxypyridine-3-carboxamide |
| Molecular Weight: | 343.38 |
| Molecular Formula: | C17 H21 N5 O3 |
| Smiles: | C1CC2=NN(CC3CC3)C(N2CCC1NC(c1ccc(nc1)O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.0561 |
| logD: | 0.8253 |
| logSw: | -1.7801 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 84.382 |
| InChI Key: | OQMHWQFBABTQNH-CYBMUJFWSA-N |