4-phenyl-5-{[3-(thiophen-2-yl)-1H-pyrazol-4-yl]methyl}-1,5-diazecan-2-one
Chemical Structure Depiction of
4-phenyl-5-{[3-(thiophen-2-yl)-1H-pyrazol-4-yl]methyl}-1,5-diazecan-2-one
4-phenyl-5-{[3-(thiophen-2-yl)-1H-pyrazol-4-yl]methyl}-1,5-diazecan-2-one
Compound characteristics
| Compound ID: | S734-0188 |
| Compound Name: | 4-phenyl-5-{[3-(thiophen-2-yl)-1H-pyrazol-4-yl]methyl}-1,5-diazecan-2-one |
| Molecular Weight: | 394.54 |
| Molecular Formula: | C22 H26 N4 O S |
| Smiles: | C1CCNC(CC(c2ccccc2)N(CC1)Cc1c[nH]nc1c1cccs1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.2198 |
| logD: | 2.1911 |
| logSw: | -3.1328 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 54.122 |
| InChI Key: | IPMNBIDPLRZHFE-IBGZPJMESA-N |