N-({1-[(4-bromophenyl)methyl]-1H-pyrrol-2-yl}methyl)-N-butyl-N~2~-[(2,4-dimethylphenyl)carbamoyl]-N~2~-(3-methoxypropyl)glycinamide
Chemical Structure Depiction of
N-({1-[(4-bromophenyl)methyl]-1H-pyrrol-2-yl}methyl)-N-butyl-N~2~-[(2,4-dimethylphenyl)carbamoyl]-N~2~-(3-methoxypropyl)glycinamide
N-({1-[(4-bromophenyl)methyl]-1H-pyrrol-2-yl}methyl)-N-butyl-N~2~-[(2,4-dimethylphenyl)carbamoyl]-N~2~-(3-methoxypropyl)glycinamide
Compound characteristics
| Compound ID: | V018-0931 |
| Compound Name: | N-({1-[(4-bromophenyl)methyl]-1H-pyrrol-2-yl}methyl)-N-butyl-N~2~-[(2,4-dimethylphenyl)carbamoyl]-N~2~-(3-methoxypropyl)glycinamide |
| Molecular Weight: | 597.6 |
| Molecular Formula: | C31 H41 Br N4 O3 |
| Smiles: | CCCCN(Cc1cccn1Cc1ccc(cc1)[Br])C(CN(CCCOC)C(Nc1ccc(C)cc1C)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.5624 |
| logD: | 6.5624 |
| logSw: | -5.3924 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.897 |
| InChI Key: | PIVFOIXIYHDZJZ-UHFFFAOYSA-N |