[4-(3-benzyl-8-chloro[1,2,4]triazolo[4,3-c]quinazolin-5-yl)piperazin-1-yl](thiophen-2-yl)methanone
Chemical Structure Depiction of
[4-(3-benzyl-8-chloro[1,2,4]triazolo[4,3-c]quinazolin-5-yl)piperazin-1-yl](thiophen-2-yl)methanone
[4-(3-benzyl-8-chloro[1,2,4]triazolo[4,3-c]quinazolin-5-yl)piperazin-1-yl](thiophen-2-yl)methanone
Compound characteristics
| Compound ID: | V022-7991 |
| Compound Name: | [4-(3-benzyl-8-chloro[1,2,4]triazolo[4,3-c]quinazolin-5-yl)piperazin-1-yl](thiophen-2-yl)methanone |
| Molecular Weight: | 489 |
| Molecular Formula: | C25 H21 Cl N6 O S |
| Salt: | not_available |
| Smiles: | C(c1ccccc1)c1nnc2c3ccc(cc3nc(N3CCN(CC3)C(c3cccs3)=O)n12)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.9824 |
| logD: | 4.9671 |
| logSw: | -5.158 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 51.444 |
| InChI Key: | NKUMWCRRBMVSHY-UHFFFAOYSA-N |