N-[2-(azepan-1-yl)pyrimidin-5-yl]-3-methylthiophene-2-carboxamide
Chemical Structure Depiction of
N-[2-(azepan-1-yl)pyrimidin-5-yl]-3-methylthiophene-2-carboxamide
N-[2-(azepan-1-yl)pyrimidin-5-yl]-3-methylthiophene-2-carboxamide
Compound characteristics
| Compound ID: | P209-0618 |
| Compound Name: | N-[2-(azepan-1-yl)pyrimidin-5-yl]-3-methylthiophene-2-carboxamide |
| Molecular Weight: | 316.42 |
| Molecular Formula: | C16 H20 N4 O S |
| Smiles: | Cc1ccsc1C(Nc1cnc(nc1)N1CCCCCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5508 |
| logD: | 3.5446 |
| logSw: | -3.5284 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.673 |
| InChI Key: | IRFQMQCTOMMIFS-UHFFFAOYSA-N |