N-{2-[({1-[(4-bromophenyl)methyl]-1H-pyrrol-2-yl}methyl)(butyl)amino]-2-oxoethyl}-N-(3-methoxypropyl)hexanamide
Chemical Structure Depiction of
N-{2-[({1-[(4-bromophenyl)methyl]-1H-pyrrol-2-yl}methyl)(butyl)amino]-2-oxoethyl}-N-(3-methoxypropyl)hexanamide
N-{2-[({1-[(4-bromophenyl)methyl]-1H-pyrrol-2-yl}methyl)(butyl)amino]-2-oxoethyl}-N-(3-methoxypropyl)hexanamide
Compound characteristics
| Compound ID: | V010-1039 |
| Compound Name: | N-{2-[({1-[(4-bromophenyl)methyl]-1H-pyrrol-2-yl}methyl)(butyl)amino]-2-oxoethyl}-N-(3-methoxypropyl)hexanamide |
| Molecular Weight: | 548.56 |
| Molecular Formula: | C28 H42 Br N3 O3 |
| Smiles: | CCCCCC(N(CCCOC)CC(N(CCCC)Cc1cccn1Cc1ccc(cc1)[Br])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.9577 |
| logD: | 5.9577 |
| logSw: | -5.2082 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 42.518 |
| InChI Key: | OJRDFRRBDDWQGT-UHFFFAOYSA-N |