(2,6-difluorophenyl)[4-(3-phenyl[1,2,4]triazolo[4,3-c]quinazolin-5-yl)-1,4-diazepan-1-yl]methanone
Chemical Structure Depiction of
(2,6-difluorophenyl)[4-(3-phenyl[1,2,4]triazolo[4,3-c]quinazolin-5-yl)-1,4-diazepan-1-yl]methanone
(2,6-difluorophenyl)[4-(3-phenyl[1,2,4]triazolo[4,3-c]quinazolin-5-yl)-1,4-diazepan-1-yl]methanone
Compound characteristics
| Compound ID: | V021-6130 |
| Compound Name: | (2,6-difluorophenyl)[4-(3-phenyl[1,2,4]triazolo[4,3-c]quinazolin-5-yl)-1,4-diazepan-1-yl]methanone |
| Molecular Weight: | 484.51 |
| Molecular Formula: | C27 H22 F2 N6 O |
| Salt: | not_available |
| Smiles: | C1CN(CCN(C1)c1nc2ccccc2c2nnc(c3ccccc3)n12)C(c1c(cccc1F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7163 |
| logD: | 4.6551 |
| logSw: | -4.9995 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 49.78 |
| InChI Key: | KWQJXSQDXNBHDU-UHFFFAOYSA-N |