N-[3-(1H-benzimidazol-2-yl)propyl]-3,5-dimethyl-5,6-dihydro-8H-[1,2,4]triazolo[3,4-c][1,4]oxazine-5-carboxamide
Chemical Structure Depiction of
N-[3-(1H-benzimidazol-2-yl)propyl]-3,5-dimethyl-5,6-dihydro-8H-[1,2,4]triazolo[3,4-c][1,4]oxazine-5-carboxamide
N-[3-(1H-benzimidazol-2-yl)propyl]-3,5-dimethyl-5,6-dihydro-8H-[1,2,4]triazolo[3,4-c][1,4]oxazine-5-carboxamide
Compound characteristics
| Compound ID: | SA31-0095 |
| Compound Name: | N-[3-(1H-benzimidazol-2-yl)propyl]-3,5-dimethyl-5,6-dihydro-8H-[1,2,4]triazolo[3,4-c][1,4]oxazine-5-carboxamide |
| Molecular Weight: | 354.41 |
| Molecular Formula: | C18 H22 N6 O2 |
| Smiles: | Cc1nnc2COCC(C)(C(NCCCc3nc4ccccc4[nH]3)=O)n12 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.3488 |
| logD: | 0.3411 |
| logSw: | -1.7289 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 80.255 |
| InChI Key: | PQPFLVVSPYZRNM-SFHVURJKSA-N |