N-(2-{[2-(3,4-dimethoxyphenyl)ethyl][(3-methylthiophen-2-yl)methyl]amino}-2-oxoethyl)-N-(2-methoxyethyl)adamantane-1-carboxamide
Chemical Structure Depiction of
N-(2-{[2-(3,4-dimethoxyphenyl)ethyl][(3-methylthiophen-2-yl)methyl]amino}-2-oxoethyl)-N-(2-methoxyethyl)adamantane-1-carboxamide
N-(2-{[2-(3,4-dimethoxyphenyl)ethyl][(3-methylthiophen-2-yl)methyl]amino}-2-oxoethyl)-N-(2-methoxyethyl)adamantane-1-carboxamide
Compound characteristics
| Compound ID: | V001-1722 |
| Compound Name: | N-(2-{[2-(3,4-dimethoxyphenyl)ethyl][(3-methylthiophen-2-yl)methyl]amino}-2-oxoethyl)-N-(2-methoxyethyl)adamantane-1-carboxamide |
| Molecular Weight: | 568.78 |
| Molecular Formula: | C32 H44 N2 O5 S |
| Smiles: | Cc1ccsc1CN(CCc1ccc(c(c1)OC)OC)C(CN(CCOC)C(C12CC3CC(CC(C3)C2)C1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.4239 |
| logD: | 5.4239 |
| logSw: | -5.4666 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 56.745 |
| InChI Key: | PMNJYWLFORRHIN-UHFFFAOYSA-N |