1-(4-{5-[({4-[benzyl(methyl)amino]-6-tert-butylpyrimidin-2-yl}sulfanyl)methyl]furan-2-carbonyl}piperazin-1-yl)ethan-1-one
Chemical Structure Depiction of
1-(4-{5-[({4-[benzyl(methyl)amino]-6-tert-butylpyrimidin-2-yl}sulfanyl)methyl]furan-2-carbonyl}piperazin-1-yl)ethan-1-one
1-(4-{5-[({4-[benzyl(methyl)amino]-6-tert-butylpyrimidin-2-yl}sulfanyl)methyl]furan-2-carbonyl}piperazin-1-yl)ethan-1-one
Compound characteristics
| Compound ID: | V026-2055 |
| Compound Name: | 1-(4-{5-[({4-[benzyl(methyl)amino]-6-tert-butylpyrimidin-2-yl}sulfanyl)methyl]furan-2-carbonyl}piperazin-1-yl)ethan-1-one |
| Molecular Weight: | 521.68 |
| Molecular Formula: | C28 H35 N5 O3 S |
| Salt: | not_available |
| Smiles: | CC(N1CCN(CC1)C(c1ccc(CSc2nc(cc(n2)N(C)Cc2ccccc2)C(C)(C)C)o1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2372 |
| logD: | 5.194 |
| logSw: | -5.063 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 61.363 |
| InChI Key: | QVHVNJHJYBGGDN-UHFFFAOYSA-N |