N-(butan-2-yl)-5-({8-methyl-5-[(4-methylphenyl)methyl]-5H-[1,2,4]triazino[5,6-b]indol-3-yl}sulfanyl)pentanamide
Chemical Structure Depiction of
N-(butan-2-yl)-5-({8-methyl-5-[(4-methylphenyl)methyl]-5H-[1,2,4]triazino[5,6-b]indol-3-yl}sulfanyl)pentanamide
N-(butan-2-yl)-5-({8-methyl-5-[(4-methylphenyl)methyl]-5H-[1,2,4]triazino[5,6-b]indol-3-yl}sulfanyl)pentanamide
Compound characteristics
| Compound ID: | V009-7801 |
| Compound Name: | N-(butan-2-yl)-5-({8-methyl-5-[(4-methylphenyl)methyl]-5H-[1,2,4]triazino[5,6-b]indol-3-yl}sulfanyl)pentanamide |
| Molecular Weight: | 475.66 |
| Molecular Formula: | C27 H33 N5 O S |
| Salt: | not_available |
| Smiles: | CCC(C)NC(CCCCSc1nc2c(c3cc(C)ccc3n2Cc2ccc(C)cc2)nn1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.7756 |
| logD: | 5.7756 |
| logSw: | -5.312 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.891 |
| InChI Key: | NXPLHVXOKBEMHD-FQEVSTJZSA-N |