methyl 4-[2-({6-[4-(2-methoxyphenyl)piperazin-1-yl]pyridazin-3-yl}sulfanyl)acetamido]benzoate
Chemical Structure Depiction of
methyl 4-[2-({6-[4-(2-methoxyphenyl)piperazin-1-yl]pyridazin-3-yl}sulfanyl)acetamido]benzoate
methyl 4-[2-({6-[4-(2-methoxyphenyl)piperazin-1-yl]pyridazin-3-yl}sulfanyl)acetamido]benzoate
Compound characteristics
Compound ID: | L383-1067 |
Compound Name: | methyl 4-[2-({6-[4-(2-methoxyphenyl)piperazin-1-yl]pyridazin-3-yl}sulfanyl)acetamido]benzoate |
Molecular Weight: | 493.58 |
Molecular Formula: | C25 H27 N5 O4 S |
Smiles: | COC(c1ccc(cc1)NC(CSc1ccc(nn1)N1CCN(CC1)c1ccccc1OC)=O)=O |
Stereo: | ACHIRAL |
logP: | 4.0974 |
logD: | 4.097 |
logSw: | -4.154 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 78.9 |
InChI Key: | GGKWYBLRLIRWSI-UHFFFAOYSA-N |