3-[({4-tert-butyl-6-[4-(4-methoxyphenyl)piperazin-1-yl]pyrimidin-2-yl}sulfanyl)methyl]-N-(cyclopropylmethyl)benzamide
Chemical Structure Depiction of
3-[({4-tert-butyl-6-[4-(4-methoxyphenyl)piperazin-1-yl]pyrimidin-2-yl}sulfanyl)methyl]-N-(cyclopropylmethyl)benzamide
3-[({4-tert-butyl-6-[4-(4-methoxyphenyl)piperazin-1-yl]pyrimidin-2-yl}sulfanyl)methyl]-N-(cyclopropylmethyl)benzamide
Compound characteristics
| Compound ID: | V003-5233 |
| Compound Name: | 3-[({4-tert-butyl-6-[4-(4-methoxyphenyl)piperazin-1-yl]pyrimidin-2-yl}sulfanyl)methyl]-N-(cyclopropylmethyl)benzamide |
| Molecular Weight: | 545.75 |
| Molecular Formula: | C31 H39 N5 O2 S |
| Salt: | not_available |
| Smiles: | CC(C)(C)c1cc(nc(n1)SCc1cccc(c1)C(NCC1CC1)=O)N1CCN(CC1)c1ccc(cc1)OC |
| Stereo: | ACHIRAL |
| logP: | 6.8161 |
| logD: | 6.8155 |
| logSw: | -5.6936 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.917 |
| InChI Key: | CTGQVYBOJFDCCD-UHFFFAOYSA-N |