4-{1-[(5-benzyl-4-cyclohexyl-4H-1,2,4-triazol-3-yl)sulfanyl]ethyl}-6-(3,4-dihydroquinolin-1(2H)-yl)-1,3,5-triazin-2-amine
Chemical Structure Depiction of
4-{1-[(5-benzyl-4-cyclohexyl-4H-1,2,4-triazol-3-yl)sulfanyl]ethyl}-6-(3,4-dihydroquinolin-1(2H)-yl)-1,3,5-triazin-2-amine
4-{1-[(5-benzyl-4-cyclohexyl-4H-1,2,4-triazol-3-yl)sulfanyl]ethyl}-6-(3,4-dihydroquinolin-1(2H)-yl)-1,3,5-triazin-2-amine
Compound characteristics
| Compound ID: | 8018-9477 |
| Compound Name: | 4-{1-[(5-benzyl-4-cyclohexyl-4H-1,2,4-triazol-3-yl)sulfanyl]ethyl}-6-(3,4-dihydroquinolin-1(2H)-yl)-1,3,5-triazin-2-amine |
| Molecular Weight: | 526.71 |
| Molecular Formula: | C29 H34 N8 S |
| Smiles: | CC(c1nc(N)nc(n1)N1CCCc2ccccc12)Sc1nnc(Cc2ccccc2)n1C1CCCCC1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.3748 |
| logD: | 6.3696 |
| logSw: | -5.6312 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 76.898 |
| InChI Key: | GOUONEFSRMNNQD-FQEVSTJZSA-N |