1-{3-[4-(diphenylmethyl)piperazin-1-yl]-3-oxopropyl}-4-(2-methylpropyl)[1,2,4]triazolo[4,3-a]quinazolin-5(4H)-one
Chemical Structure Depiction of
1-{3-[4-(diphenylmethyl)piperazin-1-yl]-3-oxopropyl}-4-(2-methylpropyl)[1,2,4]triazolo[4,3-a]quinazolin-5(4H)-one
1-{3-[4-(diphenylmethyl)piperazin-1-yl]-3-oxopropyl}-4-(2-methylpropyl)[1,2,4]triazolo[4,3-a]quinazolin-5(4H)-one
Compound characteristics
| Compound ID: | C741-1047 |
| Compound Name: | 1-{3-[4-(diphenylmethyl)piperazin-1-yl]-3-oxopropyl}-4-(2-methylpropyl)[1,2,4]triazolo[4,3-a]quinazolin-5(4H)-one |
| Molecular Weight: | 548.69 |
| Molecular Formula: | C33 H36 N6 O2 |
| Smiles: | CC(C)CN1C(c2ccccc2n2c(CCC(N3CCN(CC3)C(c3ccccc3)c3ccccc3)=O)nnc12)=O |
| Stereo: | ACHIRAL |
| logP: | 4.392 |
| logD: | 4.3885 |
| logSw: | -4.3447 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 58.932 |
| InChI Key: | CJDNPIDAVRHSBX-UHFFFAOYSA-N |