methyl 4-{[(4-bromophenyl)(4-butyl-3,5-dioxo-1,2-diphenylpyrazolidin-4-yl)methyl]amino}benzoate
Chemical Structure Depiction of
methyl 4-{[(4-bromophenyl)(4-butyl-3,5-dioxo-1,2-diphenylpyrazolidin-4-yl)methyl]amino}benzoate
methyl 4-{[(4-bromophenyl)(4-butyl-3,5-dioxo-1,2-diphenylpyrazolidin-4-yl)methyl]amino}benzoate
Compound characteristics
| Compound ID: | 8014-8240 |
| Compound Name: | methyl 4-{[(4-bromophenyl)(4-butyl-3,5-dioxo-1,2-diphenylpyrazolidin-4-yl)methyl]amino}benzoate |
| Molecular Weight: | 626.55 |
| Molecular Formula: | C34 H32 Br N3 O4 |
| Smiles: | CCCCC1(C(c2ccc(cc2)[Br])Nc2ccc(cc2)C(=O)OC)C(N(c2ccccc2)N(C1=O)c1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 7.6069 |
| logD: | 7.6069 |
| logSw: | -5.8569 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.724 |
| InChI Key: | REXDIKPFNKTSBP-SSEXGKCCSA-N |