(2H-1,3-benzodioxol-5-yl){4-[8-chloro-3-(3-methylphenyl)[1,2,4]triazolo[4,3-c]quinazolin-5-yl]piperazin-1-yl}methanone
Chemical Structure Depiction of
(2H-1,3-benzodioxol-5-yl){4-[8-chloro-3-(3-methylphenyl)[1,2,4]triazolo[4,3-c]quinazolin-5-yl]piperazin-1-yl}methanone
(2H-1,3-benzodioxol-5-yl){4-[8-chloro-3-(3-methylphenyl)[1,2,4]triazolo[4,3-c]quinazolin-5-yl]piperazin-1-yl}methanone
Compound characteristics
| Compound ID: | V025-0281 |
| Compound Name: | (2H-1,3-benzodioxol-5-yl){4-[8-chloro-3-(3-methylphenyl)[1,2,4]triazolo[4,3-c]quinazolin-5-yl]piperazin-1-yl}methanone |
| Molecular Weight: | 526.98 |
| Molecular Formula: | C28 H23 Cl N6 O3 |
| Salt: | not_available |
| Smiles: | Cc1cccc(c1)c1nnc2c3ccc(cc3nc(N3CCN(CC3)C(c3ccc4c(c3)OCO4)=O)n12)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 5.4208 |
| logD: | 5.1401 |
| logSw: | -6.0744 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 66.565 |
| InChI Key: | UJLXFWHIAPYNJZ-UHFFFAOYSA-N |