N-(3-chloro-4-methoxyphenyl)-2-[6-(2-methylpropane-2-sulfonyl)-3-oxo[1,2,4]triazolo[4,3-b]pyridazin-2(3H)-yl]acetamide
Chemical Structure Depiction of
N-(3-chloro-4-methoxyphenyl)-2-[6-(2-methylpropane-2-sulfonyl)-3-oxo[1,2,4]triazolo[4,3-b]pyridazin-2(3H)-yl]acetamide
N-(3-chloro-4-methoxyphenyl)-2-[6-(2-methylpropane-2-sulfonyl)-3-oxo[1,2,4]triazolo[4,3-b]pyridazin-2(3H)-yl]acetamide
Compound characteristics
| Compound ID: | C201-1300 |
| Compound Name: | N-(3-chloro-4-methoxyphenyl)-2-[6-(2-methylpropane-2-sulfonyl)-3-oxo[1,2,4]triazolo[4,3-b]pyridazin-2(3H)-yl]acetamide |
| Molecular Weight: | 453.9 |
| Molecular Formula: | C18 H20 Cl N5 O5 S |
| Smiles: | CC(C)(C)S(C1C=CC2=NN(CC(Nc3ccc(c(c3)[Cl])OC)=O)C(N2N=1)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5696 |
| logD: | 2.5695 |
| logSw: | -3.3691 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 105.364 |
| InChI Key: | SZETXZGCBDTASE-UHFFFAOYSA-N |