[4-(3-phenyl-1H-pyrazol-5-yl)-1,4-diazepan-1-yl](3,4,5-triethoxyphenyl)methanone
Chemical Structure Depiction of
[4-(3-phenyl-1H-pyrazol-5-yl)-1,4-diazepan-1-yl](3,4,5-triethoxyphenyl)methanone
[4-(3-phenyl-1H-pyrazol-5-yl)-1,4-diazepan-1-yl](3,4,5-triethoxyphenyl)methanone
Compound characteristics
| Compound ID: | P803-0874 |
| Compound Name: | [4-(3-phenyl-1H-pyrazol-5-yl)-1,4-diazepan-1-yl](3,4,5-triethoxyphenyl)methanone |
| Molecular Weight: | 478.59 |
| Molecular Formula: | C27 H34 N4 O4 |
| Smiles: | CCOc1cc(cc(c1OCC)OCC)C(N1CCCN(CC1)c1cc(c2ccccc2)n[nH]1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2123 |
| logD: | 4.2123 |
| logSw: | -4.031 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.149 |
| InChI Key: | URDCKUZYFKWENY-UHFFFAOYSA-N |