6-(2-{[1-(4-methoxyphenyl)-3-phenyl-1H-pyrazol-5-yl]amino}-1,3-thiazol-4-yl)-2H-1,4-benzoxazin-3(4H)-one
Chemical Structure Depiction of
6-(2-{[1-(4-methoxyphenyl)-3-phenyl-1H-pyrazol-5-yl]amino}-1,3-thiazol-4-yl)-2H-1,4-benzoxazin-3(4H)-one
6-(2-{[1-(4-methoxyphenyl)-3-phenyl-1H-pyrazol-5-yl]amino}-1,3-thiazol-4-yl)-2H-1,4-benzoxazin-3(4H)-one
Compound characteristics
| Compound ID: | 8539-0716 |
| Compound Name: | 6-(2-{[1-(4-methoxyphenyl)-3-phenyl-1H-pyrazol-5-yl]amino}-1,3-thiazol-4-yl)-2H-1,4-benzoxazin-3(4H)-one |
| Molecular Weight: | 495.56 |
| Molecular Formula: | C27 H21 N5 O3 S |
| Smiles: | COc1ccc(cc1)n1c(cc(c2ccccc2)n1)Nc1nc(cs1)c1ccc2c(c1)NC(CO2)=O |
| Stereo: | ACHIRAL |
| logP: | 6.2496 |
| logD: | 6.2496 |
| logSw: | -5.584 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 73.903 |
| InChI Key: | XDTLKQOHGYSBED-UHFFFAOYSA-N |