methyl 5-amino-1-(4-{[(5-bromo-2-methoxyphenyl)methyl]carbamoyl}phenyl)-1H-pyrazole-4-carboxylate
Chemical Structure Depiction of
methyl 5-amino-1-(4-{[(5-bromo-2-methoxyphenyl)methyl]carbamoyl}phenyl)-1H-pyrazole-4-carboxylate
methyl 5-amino-1-(4-{[(5-bromo-2-methoxyphenyl)methyl]carbamoyl}phenyl)-1H-pyrazole-4-carboxylate
Compound characteristics
Compound ID: | G892-1225 |
Compound Name: | methyl 5-amino-1-(4-{[(5-bromo-2-methoxyphenyl)methyl]carbamoyl}phenyl)-1H-pyrazole-4-carboxylate |
Molecular Weight: | 459.3 |
Molecular Formula: | C20 H19 Br N4 O4 |
Smiles: | COC(c1cnn(c2ccc(cc2)C(NCc2cc(ccc2OC)[Br])=O)c1N)=O |
Stereo: | ACHIRAL |
logP: | 3.1639 |
logD: | 3.1638 |
logSw: | -3.4041 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 3 |
Polar surface area: | 86.772 |
InChI Key: | FQYVRMUZHZWTFG-UHFFFAOYSA-N |