N-({[2-(5-chloro-1H-indol-3-yl)ethyl]amino}[(4,6-dimethylpyrimidin-2-yl)amino]methylidene)-2-phenylbutanamide
Chemical Structure Depiction of
N-({[2-(5-chloro-1H-indol-3-yl)ethyl]amino}[(4,6-dimethylpyrimidin-2-yl)amino]methylidene)-2-phenylbutanamide
N-({[2-(5-chloro-1H-indol-3-yl)ethyl]amino}[(4,6-dimethylpyrimidin-2-yl)amino]methylidene)-2-phenylbutanamide
Compound characteristics
| Compound ID: | Y021-1934 |
| Compound Name: | N-({[2-(5-chloro-1H-indol-3-yl)ethyl]amino}[(4,6-dimethylpyrimidin-2-yl)amino]methylidene)-2-phenylbutanamide |
| Molecular Weight: | 489.02 |
| Molecular Formula: | C27 H29 Cl N6 O |
| Smiles: | CCC(C(/N=C(\NCCc1c[nH]c2ccc(cc12)[Cl])Nc1nc(C)cc(C)n1)=O)c1ccccc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.1651 |
| logD: | 4.6771 |
| logSw: | -5.5503 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 70.882 |
| InChI Key: | POAXULJIJRGNEP-JOCHJYFZSA-N |