N-{3-[(2-bromophenyl)carbamamido]-4-(pyrrolidin-1-yl)phenyl}-3-methylbenzamide
Chemical Structure Depiction of
N-{3-[(2-bromophenyl)carbamamido]-4-(pyrrolidin-1-yl)phenyl}-3-methylbenzamide
N-{3-[(2-bromophenyl)carbamamido]-4-(pyrrolidin-1-yl)phenyl}-3-methylbenzamide
Compound characteristics
| Compound ID: | F694-0616 |
| Compound Name: | N-{3-[(2-bromophenyl)carbamamido]-4-(pyrrolidin-1-yl)phenyl}-3-methylbenzamide |
| Molecular Weight: | 493.4 |
| Molecular Formula: | C25 H25 Br N4 O2 |
| Smiles: | Cc1cccc(c1)C(Nc1ccc(c(c1)NC(Nc1ccccc1[Br])=O)N1CCCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.8381 |
| logD: | 5.8359 |
| logSw: | -5.4704 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 57.755 |
| InChI Key: | VALDEWHLJJRFLP-UHFFFAOYSA-N |