N-benzyl-N-{[1-(3-chlorophenyl)-5-(4-methoxyphenoxy)-3-methyl-1H-pyrazol-4-yl]methyl}thiophene-2-carboxamide
Chemical Structure Depiction of
N-benzyl-N-{[1-(3-chlorophenyl)-5-(4-methoxyphenoxy)-3-methyl-1H-pyrazol-4-yl]methyl}thiophene-2-carboxamide
N-benzyl-N-{[1-(3-chlorophenyl)-5-(4-methoxyphenoxy)-3-methyl-1H-pyrazol-4-yl]methyl}thiophene-2-carboxamide
Compound characteristics
| Compound ID: | V003-2342 |
| Compound Name: | N-benzyl-N-{[1-(3-chlorophenyl)-5-(4-methoxyphenoxy)-3-methyl-1H-pyrazol-4-yl]methyl}thiophene-2-carboxamide |
| Molecular Weight: | 544.07 |
| Molecular Formula: | C30 H26 Cl N3 O3 S |
| Smiles: | Cc1c(CN(Cc2ccccc2)C(c2cccs2)=O)c(n(c2cccc(c2)[Cl])n1)Oc1ccc(cc1)OC |
| Stereo: | ACHIRAL |
| logP: | 6.9238 |
| logD: | 6.9238 |
| logSw: | -6.2303 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 45.422 |
| InChI Key: | VTFPAPQAEHKMMC-UHFFFAOYSA-N |