N-(4-butylphenyl)-2-[3-(3-methylbenzene-1-sulfonyl)-6-oxopyridazin-1(6H)-yl]acetamide
Chemical Structure Depiction of
N-(4-butylphenyl)-2-[3-(3-methylbenzene-1-sulfonyl)-6-oxopyridazin-1(6H)-yl]acetamide
N-(4-butylphenyl)-2-[3-(3-methylbenzene-1-sulfonyl)-6-oxopyridazin-1(6H)-yl]acetamide
Compound characteristics
Compound ID: | F809-0802 |
Compound Name: | N-(4-butylphenyl)-2-[3-(3-methylbenzene-1-sulfonyl)-6-oxopyridazin-1(6H)-yl]acetamide |
Molecular Weight: | 439.53 |
Molecular Formula: | C23 H25 N3 O4 S |
Smiles: | CCCCc1ccc(cc1)NC(CN1C(C=CC(=N1)S(c1cccc(C)c1)(=O)=O)=O)=O |
Stereo: | ACHIRAL |
logP: | 4.4482 |
logD: | 4.4482 |
logSw: | -4.3185 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 81.253 |
InChI Key: | BPCMVEASNAEOFK-UHFFFAOYSA-N |