N-(2-{[2-(1H-indol-3-yl)ethyl][(4-methylphenyl)methyl]amino}-2-oxoethyl)-4-methyl-3-nitro-N-propylbenzamide
Chemical Structure Depiction of
N-(2-{[2-(1H-indol-3-yl)ethyl][(4-methylphenyl)methyl]amino}-2-oxoethyl)-4-methyl-3-nitro-N-propylbenzamide
N-(2-{[2-(1H-indol-3-yl)ethyl][(4-methylphenyl)methyl]amino}-2-oxoethyl)-4-methyl-3-nitro-N-propylbenzamide
Compound characteristics
| Compound ID: | V005-1778 |
| Compound Name: | N-(2-{[2-(1H-indol-3-yl)ethyl][(4-methylphenyl)methyl]amino}-2-oxoethyl)-4-methyl-3-nitro-N-propylbenzamide |
| Molecular Weight: | 526.64 |
| Molecular Formula: | C31 H34 N4 O4 |
| Smiles: | CCCN(CC(N(CCc1c[nH]c2ccccc12)Cc1ccc(C)cc1)=O)C(c1ccc(C)c(c1)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2713 |
| logD: | 5.2713 |
| logSw: | -5.4485 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.041 |
| InChI Key: | MIKFDPRQQKVYIM-UHFFFAOYSA-N |