5-{[3-(4-methoxyphenyl)-1H-pyrazol-4-yl]methyl}-4-phenyl-1,5-diazecan-2-one
Chemical Structure Depiction of
5-{[3-(4-methoxyphenyl)-1H-pyrazol-4-yl]methyl}-4-phenyl-1,5-diazecan-2-one
5-{[3-(4-methoxyphenyl)-1H-pyrazol-4-yl]methyl}-4-phenyl-1,5-diazecan-2-one
Compound characteristics
| Compound ID: | S734-0187 |
| Compound Name: | 5-{[3-(4-methoxyphenyl)-1H-pyrazol-4-yl]methyl}-4-phenyl-1,5-diazecan-2-one |
| Molecular Weight: | 418.54 |
| Molecular Formula: | C25 H30 N4 O2 |
| Smiles: | COc1ccc(cc1)c1c(CN2CCCCCNC(CC2c2ccccc2)=O)c[nH]n1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.253 |
| logD: | 2.3789 |
| logSw: | -3.1634 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 60.647 |
| InChI Key: | TYGLIVXRQUJDCD-QHCPKHFHSA-N |