N-(cyclopropylmethyl)-4-[({4-[4-(2-fluorophenyl)piperazin-1-yl]-6-methylpyrimidin-2-yl}sulfanyl)methyl]benzamide
Chemical Structure Depiction of
N-(cyclopropylmethyl)-4-[({4-[4-(2-fluorophenyl)piperazin-1-yl]-6-methylpyrimidin-2-yl}sulfanyl)methyl]benzamide
N-(cyclopropylmethyl)-4-[({4-[4-(2-fluorophenyl)piperazin-1-yl]-6-methylpyrimidin-2-yl}sulfanyl)methyl]benzamide
Compound characteristics
| Compound ID: | V005-0190 |
| Compound Name: | N-(cyclopropylmethyl)-4-[({4-[4-(2-fluorophenyl)piperazin-1-yl]-6-methylpyrimidin-2-yl}sulfanyl)methyl]benzamide |
| Molecular Weight: | 491.63 |
| Molecular Formula: | C27 H30 F N5 O S |
| Salt: | not_available |
| Smiles: | Cc1cc(nc(n1)SCc1ccc(cc1)C(NCC1CC1)=O)N1CCN(CC1)c1ccccc1F |
| Stereo: | ACHIRAL |
| logP: | 5.1793 |
| logD: | 5.179 |
| logSw: | -5.03 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.878 |
| InChI Key: | MHABQOYWWRZPAY-UHFFFAOYSA-N |