N-{N'-(3-bromophenyl)-N-[(pyridin-4-yl)methyl]carbamimidoyl}-3-(dimethylamino)benzamide
Chemical Structure Depiction of
N-{N'-(3-bromophenyl)-N-[(pyridin-4-yl)methyl]carbamimidoyl}-3-(dimethylamino)benzamide
N-{N'-(3-bromophenyl)-N-[(pyridin-4-yl)methyl]carbamimidoyl}-3-(dimethylamino)benzamide
Compound characteristics
| Compound ID: | F430-0110 |
| Compound Name: | N-{N'-(3-bromophenyl)-N-[(pyridin-4-yl)methyl]carbamimidoyl}-3-(dimethylamino)benzamide |
| Molecular Weight: | 452.35 |
| Molecular Formula: | C22 H22 Br N5 O |
| Smiles: | CN(C)c1cccc(c1)C(NC(/NCc1ccncc1)=N/c1cccc(c1)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 3.7766 |
| logD: | 3.6847 |
| logSw: | -3.8181 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 54.084 |
| InChI Key: | SMKNHPRTRBSKLL-UHFFFAOYSA-N |