(2,4-dimethoxyphenyl)[4-(3-phenyl-1H-pyrazol-5-yl)-1,4-diazepan-1-yl]methanone
Chemical Structure Depiction of
(2,4-dimethoxyphenyl)[4-(3-phenyl-1H-pyrazol-5-yl)-1,4-diazepan-1-yl]methanone
(2,4-dimethoxyphenyl)[4-(3-phenyl-1H-pyrazol-5-yl)-1,4-diazepan-1-yl]methanone
Compound characteristics
| Compound ID: | P803-0878 |
| Compound Name: | (2,4-dimethoxyphenyl)[4-(3-phenyl-1H-pyrazol-5-yl)-1,4-diazepan-1-yl]methanone |
| Molecular Weight: | 406.48 |
| Molecular Formula: | C23 H26 N4 O3 |
| Smiles: | COc1ccc(C(N2CCCN(CC2)c2cc(c3ccccc3)n[nH]2)=O)c(c1)OC |
| Stereo: | ACHIRAL |
| logP: | 3.6207 |
| logD: | 3.6207 |
| logSw: | -3.8959 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.605 |
| InChI Key: | BSVVKBSQBDDOSA-UHFFFAOYSA-N |