benzyl 4-(3-methyl[1,2,4]triazolo[4,3-c]quinazolin-5-yl)piperazine-1-carboxylate
Chemical Structure Depiction of
benzyl 4-(3-methyl[1,2,4]triazolo[4,3-c]quinazolin-5-yl)piperazine-1-carboxylate
benzyl 4-(3-methyl[1,2,4]triazolo[4,3-c]quinazolin-5-yl)piperazine-1-carboxylate
Compound characteristics
| Compound ID: | V018-3700 |
| Compound Name: | benzyl 4-(3-methyl[1,2,4]triazolo[4,3-c]quinazolin-5-yl)piperazine-1-carboxylate |
| Molecular Weight: | 402.45 |
| Molecular Formula: | C22 H22 N6 O2 |
| Salt: | not_available |
| Smiles: | Cc1nnc2c3ccccc3nc(N3CCN(CC3)C(=O)OCc3ccccc3)n12 |
| Stereo: | ACHIRAL |
| logP: | 3.3587 |
| logD: | 3.2135 |
| logSw: | -3.335 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 56.926 |
| InChI Key: | YMRKYWYUIFQHOQ-UHFFFAOYSA-N |