N-{2-[({1-[(4-bromophenyl)methyl]-1H-pyrrol-2-yl}methyl)(butyl)amino]-2-oxoethyl}-N-butyl-4-pentylbenzamide
Chemical Structure Depiction of
N-{2-[({1-[(4-bromophenyl)methyl]-1H-pyrrol-2-yl}methyl)(butyl)amino]-2-oxoethyl}-N-butyl-4-pentylbenzamide
N-{2-[({1-[(4-bromophenyl)methyl]-1H-pyrrol-2-yl}methyl)(butyl)amino]-2-oxoethyl}-N-butyl-4-pentylbenzamide
Compound characteristics
| Compound ID: | V001-4756 |
| Compound Name: | N-{2-[({1-[(4-bromophenyl)methyl]-1H-pyrrol-2-yl}methyl)(butyl)amino]-2-oxoethyl}-N-butyl-4-pentylbenzamide |
| Molecular Weight: | 608.66 |
| Molecular Formula: | C34 H46 Br N3 O2 |
| Smiles: | CCCCCc1ccc(cc1)C(N(CCCC)CC(N(CCCC)Cc1cccn1Cc1ccc(cc1)[Br])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 8.8948 |
| logD: | 8.8948 |
| logSw: | -5.7243 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 34.432 |
| InChI Key: | VQDARIPBZMOUKN-UHFFFAOYSA-N |