3-(4-bromo-2-methylanilino)-1-(4-bromo-2-methylphenyl)-4,5,6,7-tetrahydrocyclohepta[b]pyrrol-2(1H)-one
Chemical Structure Depiction of
3-(4-bromo-2-methylanilino)-1-(4-bromo-2-methylphenyl)-4,5,6,7-tetrahydrocyclohepta[b]pyrrol-2(1H)-one
3-(4-bromo-2-methylanilino)-1-(4-bromo-2-methylphenyl)-4,5,6,7-tetrahydrocyclohepta[b]pyrrol-2(1H)-one
Compound characteristics
Compound ID: | 8016-3771 |
Compound Name: | 3-(4-bromo-2-methylanilino)-1-(4-bromo-2-methylphenyl)-4,5,6,7-tetrahydrocyclohepta[b]pyrrol-2(1H)-one |
Molecular Weight: | 502.25 |
Molecular Formula: | C23 H22 Br2 N2 O |
Smiles: | Cc1cc(ccc1NC1=C2CCCCC=C2N(C1=O)c1ccc(cc1C)[Br])[Br] |
Stereo: | ACHIRAL |
logP: | 7.5589 |
logD: | 7.5572 |
logSw: | -5.5797 |
Hydrogen bond acceptors count: | 2 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 23.5502 |
InChI Key: | YYCSRIBCGGDNJE-UHFFFAOYSA-N |