N-(2-{[(3,4-dimethoxyphenyl)methyl][2-(1H-indol-3-yl)ethyl]amino}-2-oxoethyl)-N-(2-methylpropyl)adamantane-1-carboxamide
Chemical Structure Depiction of
N-(2-{[(3,4-dimethoxyphenyl)methyl][2-(1H-indol-3-yl)ethyl]amino}-2-oxoethyl)-N-(2-methylpropyl)adamantane-1-carboxamide
N-(2-{[(3,4-dimethoxyphenyl)methyl][2-(1H-indol-3-yl)ethyl]amino}-2-oxoethyl)-N-(2-methylpropyl)adamantane-1-carboxamide
Compound characteristics
| Compound ID: | V007-4571 |
| Compound Name: | N-(2-{[(3,4-dimethoxyphenyl)methyl][2-(1H-indol-3-yl)ethyl]amino}-2-oxoethyl)-N-(2-methylpropyl)adamantane-1-carboxamide |
| Molecular Weight: | 585.79 |
| Molecular Formula: | C36 H47 N3 O4 |
| Smiles: | CC(C)CN(CC(N(CCc1c[nH]c2ccccc12)Cc1ccc(c(c1)OC)OC)=O)C(C12CC3CC(CC(C3)C2)C1)=O |
| Stereo: | ACHIRAL |
| logP: | 6.4911 |
| logD: | 6.4911 |
| logSw: | -6.0085 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.277 |
| InChI Key: | OOINITLQRHVNOR-UHFFFAOYSA-N |