N-[2-(3,4-dimethoxyphenyl)ethyl]-4-(trifluoromethyl)-6,7,8,9-tetrahydro-5H-cyclohepta[d]pyrimidin-2-amine
Chemical Structure Depiction of
N-[2-(3,4-dimethoxyphenyl)ethyl]-4-(trifluoromethyl)-6,7,8,9-tetrahydro-5H-cyclohepta[d]pyrimidin-2-amine
N-[2-(3,4-dimethoxyphenyl)ethyl]-4-(trifluoromethyl)-6,7,8,9-tetrahydro-5H-cyclohepta[d]pyrimidin-2-amine
Compound characteristics
| Compound ID: | C162-0190 |
| Compound Name: | N-[2-(3,4-dimethoxyphenyl)ethyl]-4-(trifluoromethyl)-6,7,8,9-tetrahydro-5H-cyclohepta[d]pyrimidin-2-amine |
| Molecular Weight: | 395.42 |
| Molecular Formula: | C20 H24 F3 N3 O2 |
| Smiles: | COc1ccc(CCNc2nc3CCCCCc3c(C(F)(F)F)n2)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 4.4872 |
| logD: | 4.4872 |
| logSw: | -4.3528 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.804 |
| InChI Key: | MQNQKROCDWOKRD-UHFFFAOYSA-N |