N-(3-cyclopropyl-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-7-yl)-1-(2-methoxyethyl)-2,5-dimethyl-1H-pyrrole-3-carboxamide
Chemical Structure Depiction of
N-(3-cyclopropyl-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-7-yl)-1-(2-methoxyethyl)-2,5-dimethyl-1H-pyrrole-3-carboxamide
N-(3-cyclopropyl-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-7-yl)-1-(2-methoxyethyl)-2,5-dimethyl-1H-pyrrole-3-carboxamide
Compound characteristics
| Compound ID: | S637-0453 |
| Compound Name: | N-(3-cyclopropyl-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-7-yl)-1-(2-methoxyethyl)-2,5-dimethyl-1H-pyrrole-3-carboxamide |
| Molecular Weight: | 371.48 |
| Molecular Formula: | C20 H29 N5 O2 |
| Smiles: | Cc1cc(C(NC2CCc3nnc(C4CC4)n3CC2)=O)c(C)n1CCOC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.8165 |
| logD: | 1.6603 |
| logSw: | -2.3876 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.246 |
| InChI Key: | LVWCCQKZWFEYJE-INIZCTEOSA-N |