4-(azepan-1-yl)-N-(3-chloro-4-methylphenyl)[1]benzofuro[3,2-d]pyrimidine-2-carboxamide
Chemical Structure Depiction of
4-(azepan-1-yl)-N-(3-chloro-4-methylphenyl)[1]benzofuro[3,2-d]pyrimidine-2-carboxamide
4-(azepan-1-yl)-N-(3-chloro-4-methylphenyl)[1]benzofuro[3,2-d]pyrimidine-2-carboxamide
Compound characteristics
| Compound ID: | L331-0671 |
| Compound Name: | 4-(azepan-1-yl)-N-(3-chloro-4-methylphenyl)[1]benzofuro[3,2-d]pyrimidine-2-carboxamide |
| Molecular Weight: | 434.92 |
| Molecular Formula: | C24 H23 Cl N4 O2 |
| Smiles: | Cc1ccc(cc1[Cl])NC(c1nc(c2c(c3ccccc3o2)n1)N1CCCCCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 7.0654 |
| logD: | 7.0541 |
| logSw: | -6.3745 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.522 |
| InChI Key: | DMBIKVURETWITA-UHFFFAOYSA-N |