N-{2-[({1-[(4-bromophenyl)methyl]-1H-pyrrol-2-yl}methyl)(butyl)amino]-2-oxoethyl}-4-methoxy-N-pentylbenzamide
Chemical Structure Depiction of
N-{2-[({1-[(4-bromophenyl)methyl]-1H-pyrrol-2-yl}methyl)(butyl)amino]-2-oxoethyl}-4-methoxy-N-pentylbenzamide
N-{2-[({1-[(4-bromophenyl)methyl]-1H-pyrrol-2-yl}methyl)(butyl)amino]-2-oxoethyl}-4-methoxy-N-pentylbenzamide
Compound characteristics
| Compound ID: | V011-4707 |
| Compound Name: | N-{2-[({1-[(4-bromophenyl)methyl]-1H-pyrrol-2-yl}methyl)(butyl)amino]-2-oxoethyl}-4-methoxy-N-pentylbenzamide |
| Molecular Weight: | 582.58 |
| Molecular Formula: | C31 H40 Br N3 O3 |
| Smiles: | CCCCCN(CC(N(CCCC)Cc1cccn1Cc1ccc(cc1)[Br])=O)C(c1ccc(cc1)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 7.0009 |
| logD: | 7.0009 |
| logSw: | -5.688 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 41.976 |
| InChI Key: | WPIGHYPRMKLDCX-UHFFFAOYSA-N |