N-{2-[benzyl({1-[(4-fluorophenyl)methyl]-1H-pyrrol-2-yl}methyl)amino]-2-oxoethyl}-N-butyl-4-pentylbenzamide
Chemical Structure Depiction of
N-{2-[benzyl({1-[(4-fluorophenyl)methyl]-1H-pyrrol-2-yl}methyl)amino]-2-oxoethyl}-N-butyl-4-pentylbenzamide
N-{2-[benzyl({1-[(4-fluorophenyl)methyl]-1H-pyrrol-2-yl}methyl)amino]-2-oxoethyl}-N-butyl-4-pentylbenzamide
Compound characteristics
| Compound ID: | V001-4764 |
| Compound Name: | N-{2-[benzyl({1-[(4-fluorophenyl)methyl]-1H-pyrrol-2-yl}methyl)amino]-2-oxoethyl}-N-butyl-4-pentylbenzamide |
| Molecular Weight: | 581.78 |
| Molecular Formula: | C37 H44 F N3 O2 |
| Smiles: | CCCCCc1ccc(cc1)C(N(CCCC)CC(N(Cc1ccccc1)Cc1cccn1Cc1ccc(cc1)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 8.0823 |
| logD: | 8.0823 |
| logSw: | -5.7978 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 34.182 |
| InChI Key: | LQGCHVLXYYUGPB-UHFFFAOYSA-N |