methyl 4-{[5-(3-methyl-1H-pyrazol-5-yl)thiophene-2-sulfonyl]amino}benzoate
Chemical Structure Depiction of
methyl 4-{[5-(3-methyl-1H-pyrazol-5-yl)thiophene-2-sulfonyl]amino}benzoate
methyl 4-{[5-(3-methyl-1H-pyrazol-5-yl)thiophene-2-sulfonyl]amino}benzoate
Compound characteristics
Compound ID: | G275-1025 |
Compound Name: | methyl 4-{[5-(3-methyl-1H-pyrazol-5-yl)thiophene-2-sulfonyl]amino}benzoate |
Molecular Weight: | 377.44 |
Molecular Formula: | C16 H15 N3 O4 S2 |
Smiles: | Cc1cc(c2ccc(s2)S(Nc2ccc(cc2)C(=O)OC)(=O)=O)[nH]n1 |
Stereo: | ACHIRAL |
logP: | 3.632 |
logD: | 3.426 |
logSw: | -3.8948 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 85.376 |
InChI Key: | AWRYEEXXSCQBEL-UHFFFAOYSA-N |