(4-methoxy-2-methylphenyl)[4-(3-phenyl-1H-pyrazol-5-yl)-1,4-diazepan-1-yl]methanone
Chemical Structure Depiction of
(4-methoxy-2-methylphenyl)[4-(3-phenyl-1H-pyrazol-5-yl)-1,4-diazepan-1-yl]methanone
(4-methoxy-2-methylphenyl)[4-(3-phenyl-1H-pyrazol-5-yl)-1,4-diazepan-1-yl]methanone
Compound characteristics
| Compound ID: | P803-0914 |
| Compound Name: | (4-methoxy-2-methylphenyl)[4-(3-phenyl-1H-pyrazol-5-yl)-1,4-diazepan-1-yl]methanone |
| Molecular Weight: | 390.48 |
| Molecular Formula: | C23 H26 N4 O2 |
| Smiles: | Cc1cc(ccc1C(N1CCCN(CC1)c1cc(c2ccccc2)n[nH]1)=O)OC |
| Stereo: | ACHIRAL |
| logP: | 4.1099 |
| logD: | 4.1099 |
| logSw: | -4.2478 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.975 |
| InChI Key: | MRXAGQONIDQRPX-UHFFFAOYSA-N |