N-{[4-(4-methoxyphenyl)oxan-4-yl]methyl}-5-(thiophen-2-yl)-1H-pyrazole-3-carboxamide
Chemical Structure Depiction of
N-{[4-(4-methoxyphenyl)oxan-4-yl]methyl}-5-(thiophen-2-yl)-1H-pyrazole-3-carboxamide
N-{[4-(4-methoxyphenyl)oxan-4-yl]methyl}-5-(thiophen-2-yl)-1H-pyrazole-3-carboxamide
Compound characteristics
| Compound ID: | Y041-3310 |
| Compound Name: | N-{[4-(4-methoxyphenyl)oxan-4-yl]methyl}-5-(thiophen-2-yl)-1H-pyrazole-3-carboxamide |
| Molecular Weight: | 397.49 |
| Molecular Formula: | C21 H23 N3 O3 S |
| Smiles: | COc1ccc(cc1)C1(CCOCC1)CNC(c1cc(c2cccs2)[nH]n1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0466 |
| logD: | 4.0465 |
| logSw: | -4.2014 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 63.533 |
| InChI Key: | JTPPCHSNBKCBCM-UHFFFAOYSA-N |