N-[2-(azepan-1-yl)ethyl]-1-(3-fluorophenyl)-5-(1H-pyrrol-1-yl)-1H-pyrazole-4-carboxamide
Chemical Structure Depiction of
N-[2-(azepan-1-yl)ethyl]-1-(3-fluorophenyl)-5-(1H-pyrrol-1-yl)-1H-pyrazole-4-carboxamide
N-[2-(azepan-1-yl)ethyl]-1-(3-fluorophenyl)-5-(1H-pyrrol-1-yl)-1H-pyrazole-4-carboxamide
Compound characteristics
| Compound ID: | G013-0672 |
| Compound Name: | N-[2-(azepan-1-yl)ethyl]-1-(3-fluorophenyl)-5-(1H-pyrrol-1-yl)-1H-pyrazole-4-carboxamide |
| Molecular Weight: | 395.48 |
| Molecular Formula: | C22 H26 F N5 O |
| Smiles: | C1CCCN(CC1)CCNC(c1cnn(c2cccc(c2)F)c1n1cccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3195 |
| logD: | 3.3428 |
| logSw: | -4.023 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.663 |
| InChI Key: | KYIWYBXYGIDYTC-UHFFFAOYSA-N |