N-[(pyridin-3-yl)methyl]-4-({[4-(pyrrolidin-1-yl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl}methyl)benzamide
Chemical Structure Depiction of
N-[(pyridin-3-yl)methyl]-4-({[4-(pyrrolidin-1-yl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl}methyl)benzamide
N-[(pyridin-3-yl)methyl]-4-({[4-(pyrrolidin-1-yl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl}methyl)benzamide
Compound characteristics
| Compound ID: | V027-2594 |
| Compound Name: | N-[(pyridin-3-yl)methyl]-4-({[4-(pyrrolidin-1-yl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl}methyl)benzamide |
| Molecular Weight: | 473.52 |
| Molecular Formula: | C23 H22 F3 N5 O S |
| Salt: | not_available |
| Smiles: | C1CCN(C1)c1cc(C(F)(F)F)nc(n1)SCc1ccc(cc1)C(NCc1cccnc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.103 |
| logD: | 4.1029 |
| logSw: | -4.0552 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.473 |
| InChI Key: | NNPCHWCSWPWNQK-UHFFFAOYSA-N |