N-[(7-oxoazepan-2-yl)methyl]isoquinoline-1-carboxamide
Chemical Structure Depiction of
N-[(7-oxoazepan-2-yl)methyl]isoquinoline-1-carboxamide
N-[(7-oxoazepan-2-yl)methyl]isoquinoline-1-carboxamide
Compound characteristics
| Compound ID: | S562-0102 |
| Compound Name: | N-[(7-oxoazepan-2-yl)methyl]isoquinoline-1-carboxamide |
| Molecular Weight: | 297.35 |
| Molecular Formula: | C17 H19 N3 O2 |
| Smiles: | C1CCC(NC(C1)CNC(c1c2ccccc2ccn1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.3153 |
| logD: | 1.3153 |
| logSw: | -2.3224 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 60.282 |
| InChI Key: | YWTFUVDUDDWABM-CYBMUJFWSA-N |