5-(4-chlorophenyl)-7-(4-ethoxyphenyl)-6-(3-fluorophenyl)-2,3,6,7-tetrahydropyrrolo[3,4-e][1,4]diazepin-8(1H)-one
Chemical Structure Depiction of
5-(4-chlorophenyl)-7-(4-ethoxyphenyl)-6-(3-fluorophenyl)-2,3,6,7-tetrahydropyrrolo[3,4-e][1,4]diazepin-8(1H)-one
5-(4-chlorophenyl)-7-(4-ethoxyphenyl)-6-(3-fluorophenyl)-2,3,6,7-tetrahydropyrrolo[3,4-e][1,4]diazepin-8(1H)-one
Compound characteristics
Compound ID: | 8017-0405 |
Compound Name: | 5-(4-chlorophenyl)-7-(4-ethoxyphenyl)-6-(3-fluorophenyl)-2,3,6,7-tetrahydropyrrolo[3,4-e][1,4]diazepin-8(1H)-one |
Molecular Weight: | 475.95 |
Molecular Formula: | C27 H23 Cl F N3 O2 |
Smiles: | CCOc1ccc(cc1)N1C(C2=C(C1=O)NCCN=C2c1ccc(cc1)[Cl])c1cccc(c1)F |
Stereo: | RACEMIC MIXTURE |
logP: | 5.3126 |
logD: | 5.3126 |
logSw: | -6.0643 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 42.608 |
InChI Key: | GODYSTRULYQSIG-AREMUKBSSA-N |