6-(2-{[3-(4-chlorophenyl)-1-phenyl-1H-pyrazol-5-yl]amino}-1,3-thiazol-4-yl)-2H-1,4-benzoxazin-3(4H)-one
Chemical Structure Depiction of
6-(2-{[3-(4-chlorophenyl)-1-phenyl-1H-pyrazol-5-yl]amino}-1,3-thiazol-4-yl)-2H-1,4-benzoxazin-3(4H)-one
6-(2-{[3-(4-chlorophenyl)-1-phenyl-1H-pyrazol-5-yl]amino}-1,3-thiazol-4-yl)-2H-1,4-benzoxazin-3(4H)-one
Compound characteristics
| Compound ID: | 8539-0541 |
| Compound Name: | 6-(2-{[3-(4-chlorophenyl)-1-phenyl-1H-pyrazol-5-yl]amino}-1,3-thiazol-4-yl)-2H-1,4-benzoxazin-3(4H)-one |
| Molecular Weight: | 499.98 |
| Molecular Formula: | C26 H18 Cl N5 O2 S |
| Smiles: | C1C(Nc2cc(ccc2O1)c1csc(Nc2cc(c3ccc(cc3)[Cl])nn2c2ccccc2)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 6.8454 |
| logD: | 6.8454 |
| logSw: | -6.5044 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 66.359 |
| InChI Key: | MOTDTLBMMFPYIE-UHFFFAOYSA-N |