4-(azepan-1-yl)-N-[(3-bromophenyl)methyl][1]benzofuro[3,2-d]pyrimidine-2-carboxamide
Chemical Structure Depiction of
4-(azepan-1-yl)-N-[(3-bromophenyl)methyl][1]benzofuro[3,2-d]pyrimidine-2-carboxamide
4-(azepan-1-yl)-N-[(3-bromophenyl)methyl][1]benzofuro[3,2-d]pyrimidine-2-carboxamide
Compound characteristics
| Compound ID: | L331-0765 |
| Compound Name: | 4-(azepan-1-yl)-N-[(3-bromophenyl)methyl][1]benzofuro[3,2-d]pyrimidine-2-carboxamide |
| Molecular Weight: | 479.38 |
| Molecular Formula: | C24 H23 Br N4 O2 |
| Smiles: | C1CCCN(CC1)c1c2c(c3ccccc3o2)nc(C(NCc2cccc(c2)[Br])=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 6.1009 |
| logD: | 6.0992 |
| logSw: | -6.1355 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.844 |
| InChI Key: | QQDCFQFDYNGOAU-UHFFFAOYSA-N |