[4-(3-cyclohexyl[1,2,4]triazolo[4,3-c]quinazolin-5-yl)-1,4-diazepan-1-yl](thiophen-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](thiophen-2-yl)methanone
[4-(3-cyclohexyl[1,2,4]triazolo[4,3-c]quinazolin-5-yl)-1,4-diazepan-1-yl](thiophen-2-yl)methanone
Compound characteristics
Compound ID: | V018-6799 |
Compound Name: | [4-(3-cyclohexyl[1,2,4]triazolo[4,3-c]quinazolin-5-yl)-1,4-diazepan-1-yl](thiophen-2-yl)methanone |
Molecular Weight: | 460.6 |
Molecular Formula: | C25 H28 N6 O S |
Salt: | not_available |
Smiles: | C1CCC(CC1)c1nnc2c3ccccc3nc(N3CCCN(CC3)C(c3cccs3)=O)n12 |
Stereo: | ACHIRAL |
logP: | 4.9242 |
logD: | 4.924 |
logSw: | -4.9404 |
Hydrogen bond acceptors count: | 5 |
Polar surface area: | 50.991 |
InChI Key: | JNMOQUSZGJFGDH-UHFFFAOYSA-N |