2-(1,3-benzothiazol-2-yl)-4-chloro-5-(4-ethoxyanilino)pyridazin-3(2H)-one
Chemical Structure Depiction of
2-(1,3-benzothiazol-2-yl)-4-chloro-5-(4-ethoxyanilino)pyridazin-3(2H)-one
2-(1,3-benzothiazol-2-yl)-4-chloro-5-(4-ethoxyanilino)pyridazin-3(2H)-one
Compound characteristics
Compound ID: | C301-2232 |
Compound Name: | 2-(1,3-benzothiazol-2-yl)-4-chloro-5-(4-ethoxyanilino)pyridazin-3(2H)-one |
Molecular Weight: | 398.87 |
Molecular Formula: | C19 H15 Cl N4 O2 S |
Smiles: | CCOc1ccc(cc1)NC1C=NN(C(C=1[Cl])=O)c1nc2ccccc2s1 |
Stereo: | ACHIRAL |
logP: | 4.8278 |
logD: | 4.8274 |
logSw: | -4.6749 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 52.463 |
InChI Key: | MEQVVVVHGUBGQX-UHFFFAOYSA-N |