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 |