N-(cyclopropylmethyl)-3-[({4-[4-(4-methoxyphenyl)piperazin-1-yl]-6-(trifluoromethyl)pyrimidin-2-yl}sulfanyl)methyl]benzamide
Chemical Structure Depiction of
N-(cyclopropylmethyl)-3-[({4-[4-(4-methoxyphenyl)piperazin-1-yl]-6-(trifluoromethyl)pyrimidin-2-yl}sulfanyl)methyl]benzamide
N-(cyclopropylmethyl)-3-[({4-[4-(4-methoxyphenyl)piperazin-1-yl]-6-(trifluoromethyl)pyrimidin-2-yl}sulfanyl)methyl]benzamide
Compound characteristics
| Compound ID: | V027-0209 |
| Compound Name: | N-(cyclopropylmethyl)-3-[({4-[4-(4-methoxyphenyl)piperazin-1-yl]-6-(trifluoromethyl)pyrimidin-2-yl}sulfanyl)methyl]benzamide |
| Molecular Weight: | 557.64 |
| Molecular Formula: | C28 H30 F3 N5 O2 S |
| Salt: | not_available |
| Smiles: | COc1ccc(cc1)N1CCN(CC1)c1cc(C(F)(F)F)nc(n1)SCc1cccc(c1)C(NCC1CC1)=O |
| Stereo: | ACHIRAL |
| logP: | 6.1278 |
| logD: | 6.1277 |
| logSw: | -5.5648 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.917 |
| InChI Key: | LOWANESYAOJXEE-UHFFFAOYSA-N |