5-(4-bromophenyl)-3-(4-ethoxyphenyl)-4-(3-nitrophenyl)-4,5-dihydropyrrolo[3,4-c]pyrazol-6(1H)-one
Chemical Structure Depiction of
5-(4-bromophenyl)-3-(4-ethoxyphenyl)-4-(3-nitrophenyl)-4,5-dihydropyrrolo[3,4-c]pyrazol-6(1H)-one
5-(4-bromophenyl)-3-(4-ethoxyphenyl)-4-(3-nitrophenyl)-4,5-dihydropyrrolo[3,4-c]pyrazol-6(1H)-one
Compound characteristics
Compound ID: | C390-0101 |
Compound Name: | 5-(4-bromophenyl)-3-(4-ethoxyphenyl)-4-(3-nitrophenyl)-4,5-dihydropyrrolo[3,4-c]pyrazol-6(1H)-one |
Molecular Weight: | 519.35 |
Molecular Formula: | C25 H19 Br N4 O4 |
Smiles: | CCOc1ccc(cc1)c1c2C(c3cccc(c3)[N+]([O-])=O)N(C(c2[nH]n1)=O)c1ccc(cc1)[Br] |
Stereo: | RACEMIC MIXTURE |
logP: | 5.7628 |
logD: | 5.7627 |
logSw: | -5.5163 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 80.032 |
InChI Key: | JUSCWSIJWZVXCU-XMMPIXPASA-N |