3-cyclohexyl-5-[4-(3-methylbenzene-1-sulfonyl)-1,4-diazepan-1-yl][1,2,4]triazolo[4,3-c]quinazoline
Chemical Structure Depiction of
3-cyclohexyl-5-[4-(3-methylbenzene-1-sulfonyl)-1,4-diazepan-1-yl][1,2,4]triazolo[4,3-c]quinazoline
3-cyclohexyl-5-[4-(3-methylbenzene-1-sulfonyl)-1,4-diazepan-1-yl][1,2,4]triazolo[4,3-c]quinazoline
Compound characteristics
| Compound ID: | V024-1808 |
| Compound Name: | 3-cyclohexyl-5-[4-(3-methylbenzene-1-sulfonyl)-1,4-diazepan-1-yl][1,2,4]triazolo[4,3-c]quinazoline |
| Molecular Weight: | 504.65 |
| Molecular Formula: | C27 H32 N6 O2 S |
| Salt: | not_available |
| Smiles: | Cc1cccc(c1)S(N1CCCN(CC1)c1nc2ccccc2c2nnc(C3CCCCC3)n12)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.4409 |
| logD: | 5.4408 |
| logSw: | -5.6404 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 65.035 |
| InChI Key: | CIKVVKFITSIJIZ-UHFFFAOYSA-N |