[4-(3-cyclohexyl[1,2,4]triazolo[4,3-c]quinazolin-5-yl)-1,4-diazepan-1-yl](furan-2-yl)methanone
Chemical Structure Depiction of
[4-(3-cyclohexyl[1,2,4]triazolo[4,3-c]quinazolin-5-yl)-1,4-diazepan-1-yl](furan-2-yl)methanone
[4-(3-cyclohexyl[1,2,4]triazolo[4,3-c]quinazolin-5-yl)-1,4-diazepan-1-yl](furan-2-yl)methanone
Compound characteristics
| Compound ID: | V016-7508 |
| Compound Name: | [4-(3-cyclohexyl[1,2,4]triazolo[4,3-c]quinazolin-5-yl)-1,4-diazepan-1-yl](furan-2-yl)methanone |
| Molecular Weight: | 444.54 |
| Molecular Formula: | C25 H28 N6 O2 |
| Smiles: | C1CCC(CC1)c1nnc2c3ccccc3nc(N3CCCN(CC3)C(c3ccco3)=O)n12 |
| Stereo: | ACHIRAL |
| logP: | 4.2047 |
| logD: | 4.2042 |
| logSw: | -4.2083 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 58.551 |
| InChI Key: | NBVLPGPEMANGTL-UHFFFAOYSA-N |