2-chloro-N-(2-{[2-(1H-indol-3-yl)ethyl][(4-methoxyphenyl)methyl]amino}-2-oxoethyl)-N-(2-methylpropyl)-4-nitrobenzamide
Chemical Structure Depiction of
2-chloro-N-(2-{[2-(1H-indol-3-yl)ethyl][(4-methoxyphenyl)methyl]amino}-2-oxoethyl)-N-(2-methylpropyl)-4-nitrobenzamide
2-chloro-N-(2-{[2-(1H-indol-3-yl)ethyl][(4-methoxyphenyl)methyl]amino}-2-oxoethyl)-N-(2-methylpropyl)-4-nitrobenzamide
Compound characteristics
| Compound ID: | V015-4624 |
| Compound Name: | 2-chloro-N-(2-{[2-(1H-indol-3-yl)ethyl][(4-methoxyphenyl)methyl]amino}-2-oxoethyl)-N-(2-methylpropyl)-4-nitrobenzamide |
| Molecular Weight: | 577.08 |
| Molecular Formula: | C31 H33 Cl N4 O5 |
| Smiles: | CC(C)CN(CC(N(CCc1c[nH]c2ccccc12)Cc1ccc(cc1)OC)=O)C(c1ccc(cc1[Cl])[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.4431 |
| logD: | 5.4431 |
| logSw: | -6.1079 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.908 |
| InChI Key: | SSZXUSBRMQYOHC-UHFFFAOYSA-N |