3-{[3-(morpholin-4-yl)propyl]sulfanyl}-5H-[1,2,4]triazino[5,6-b]indole--hydrogen chloride (1/1)
Chemical Structure Depiction of
3-{[3-(morpholin-4-yl)propyl]sulfanyl}-5H-[1,2,4]triazino[5,6-b]indole--hydrogen chloride (1/1)
3-{[3-(morpholin-4-yl)propyl]sulfanyl}-5H-[1,2,4]triazino[5,6-b]indole--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | 1649-0172 |
| Compound Name: | 3-{[3-(morpholin-4-yl)propyl]sulfanyl}-5H-[1,2,4]triazino[5,6-b]indole--hydrogen chloride (1/1) |
| Molecular Weight: | 365.88 |
| Molecular Formula: | C16 H19 N5 O S |
| Salt: | HCl |
| Smiles: | C(CN1CCOCC1)CSc1nc2c(c3ccccc3[nH]2)nn1 |
| Stereo: | ACHIRAL |
| logP: | 1.6858 |
| logD: | 1.3579 |
| logSw: | -2.2808 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.426 |
| InChI Key: | YJMJVMXNHQDOCV-UHFFFAOYSA-N |