(2-methylphenyl){4-[3-(thiophen-2-yl)[1,2,4]triazolo[4,3-c]quinazolin-5-yl]-1,4-diazepan-1-yl}methanone
Chemical Structure Depiction of
(2-methylphenyl){4-[3-(thiophen-2-yl)[1,2,4]triazolo[4,3-c]quinazolin-5-yl]-1,4-diazepan-1-yl}methanone
(2-methylphenyl){4-[3-(thiophen-2-yl)[1,2,4]triazolo[4,3-c]quinazolin-5-yl]-1,4-diazepan-1-yl}methanone
Compound characteristics
| Compound ID: | V018-6690 |
| Compound Name: | (2-methylphenyl){4-[3-(thiophen-2-yl)[1,2,4]triazolo[4,3-c]quinazolin-5-yl]-1,4-diazepan-1-yl}methanone |
| Molecular Weight: | 468.58 |
| Molecular Formula: | C26 H24 N6 O S |
| Salt: | not_available |
| Smiles: | Cc1ccccc1C(N1CCCN(CC1)c1nc2ccccc2c2nnc(c3cccs3)n12)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6868 |
| logD: | 4.6481 |
| logSw: | -4.5174 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 50.799 |
| InChI Key: | BXVZOMPOLNWMPT-UHFFFAOYSA-N |