(2,4-difluorophenyl){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
(2,4-difluorophenyl){4-[3-(thiophen-2-yl)[1,2,4]triazolo[4,3-c]quinazolin-5-yl]-1,4-diazepan-1-yl}methanone
(2,4-difluorophenyl){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: | V008-1031 |
| Compound Name: | (2,4-difluorophenyl){4-[3-(thiophen-2-yl)[1,2,4]triazolo[4,3-c]quinazolin-5-yl]-1,4-diazepan-1-yl}methanone |
| Molecular Weight: | 490.53 |
| Molecular Formula: | C25 H20 F2 N6 O S |
| Salt: | not_available |
| Smiles: | C1CN(CCN(C1)c1nc2ccccc2c2nnc(c3cccs3)n12)C(c1ccc(cc1F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 4.753 |
| logD: | 4.7143 |
| logSw: | -4.9317 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 50.799 |
| InChI Key: | AOHAHLPSOKLEOT-UHFFFAOYSA-N |