N-[2-(benzylsulfanyl)ethyl]-4-[3-(3-methoxyphenyl)-1H-pyrazol-5-yl]benzamide
Chemical Structure Depiction of
N-[2-(benzylsulfanyl)ethyl]-4-[3-(3-methoxyphenyl)-1H-pyrazol-5-yl]benzamide
N-[2-(benzylsulfanyl)ethyl]-4-[3-(3-methoxyphenyl)-1H-pyrazol-5-yl]benzamide
Compound characteristics
| Compound ID: | V012-7011 |
| Compound Name: | N-[2-(benzylsulfanyl)ethyl]-4-[3-(3-methoxyphenyl)-1H-pyrazol-5-yl]benzamide |
| Molecular Weight: | 443.57 |
| Molecular Formula: | C26 H25 N3 O2 S |
| Salt: | not_available |
| Smiles: | COc1cccc(c1)c1cc(c2ccc(cc2)C(NCCSCc2ccccc2)=O)[nH]n1 |
| Stereo: | ACHIRAL |
| logP: | 5.3219 |
| logD: | 5.3218 |
| logSw: | -5.3514 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 54.255 |
| InChI Key: | JTVVFIRICYYWRI-UHFFFAOYSA-N |