5-(azepan-1-yl)-3-(3-bromophenyl)[1,2,3]triazolo[1,5-a]quinazoline
Chemical Structure Depiction of
5-(azepan-1-yl)-3-(3-bromophenyl)[1,2,3]triazolo[1,5-a]quinazoline
5-(azepan-1-yl)-3-(3-bromophenyl)[1,2,3]triazolo[1,5-a]quinazoline
Compound characteristics
| Compound ID: | C680-0677 |
| Compound Name: | 5-(azepan-1-yl)-3-(3-bromophenyl)[1,2,3]triazolo[1,5-a]quinazoline |
| Molecular Weight: | 422.33 |
| Molecular Formula: | C21 H20 Br N5 |
| Smiles: | C1CCCN(CC1)c1c2ccccc2n2c(c(c3cccc(c3)[Br])nn2)n1 |
| Stereo: | ACHIRAL |
| logP: | 5.9811 |
| logD: | 5.9796 |
| logSw: | -6.4699 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 35.912 |
| InChI Key: | CQVBYPRXKBDGET-UHFFFAOYSA-N |