{5-[({4-[benzyl(methyl)amino]-6-tert-butylpyrimidin-2-yl}sulfanyl)methyl]furan-2-yl}(4-methylpiperazin-1-yl)methanone
Chemical Structure Depiction of
{5-[({4-[benzyl(methyl)amino]-6-tert-butylpyrimidin-2-yl}sulfanyl)methyl]furan-2-yl}(4-methylpiperazin-1-yl)methanone
{5-[({4-[benzyl(methyl)amino]-6-tert-butylpyrimidin-2-yl}sulfanyl)methyl]furan-2-yl}(4-methylpiperazin-1-yl)methanone
Compound characteristics
| Compound ID: | V003-4699 |
| Compound Name: | {5-[({4-[benzyl(methyl)amino]-6-tert-butylpyrimidin-2-yl}sulfanyl)methyl]furan-2-yl}(4-methylpiperazin-1-yl)methanone |
| Molecular Weight: | 493.67 |
| Molecular Formula: | C27 H35 N5 O2 S |
| Salt: | not_available |
| Smiles: | CC(C)(C)c1cc(nc(n1)SCc1ccc(C(N2CCN(C)CC2)=O)o1)N(C)Cc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 5.4131 |
| logD: | 5.2853 |
| logSw: | -5.3278 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 47.645 |
| InChI Key: | FPGDMHXIOAALOW-UHFFFAOYSA-N |