3-{[2-(5-chloro-1H-indol-3-yl)ethyl]amino}-6-{[4-(propan-2-yl)phenyl]methyl}-1,2,4-triazin-5(4H)-one
Chemical Structure Depiction of
3-{[2-(5-chloro-1H-indol-3-yl)ethyl]amino}-6-{[4-(propan-2-yl)phenyl]methyl}-1,2,4-triazin-5(4H)-one
3-{[2-(5-chloro-1H-indol-3-yl)ethyl]amino}-6-{[4-(propan-2-yl)phenyl]methyl}-1,2,4-triazin-5(4H)-one
Compound characteristics
| Compound ID: | Y010-1073 |
| Compound Name: | 3-{[2-(5-chloro-1H-indol-3-yl)ethyl]amino}-6-{[4-(propan-2-yl)phenyl]methyl}-1,2,4-triazin-5(4H)-one |
| Molecular Weight: | 421.93 |
| Molecular Formula: | C23 H24 Cl N5 O |
| Smiles: | CC(C)c1ccc(CC2C(NC(NCCc3c[nH]c4ccc(cc34)[Cl])=NN=2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.3394 |
| logD: | 5.339 |
| logSw: | -6.1655 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 65.79 |
| InChI Key: | HKJIATGRGMKOQI-UHFFFAOYSA-N |