2-methyl-4-(pyrrolidin-1-yl)-6-[4-(2,4,5-trimethylbenzene-1-sulfonyl)piperazin-1-yl]pyrimidine
Chemical Structure Depiction of
2-methyl-4-(pyrrolidin-1-yl)-6-[4-(2,4,5-trimethylbenzene-1-sulfonyl)piperazin-1-yl]pyrimidine
2-methyl-4-(pyrrolidin-1-yl)-6-[4-(2,4,5-trimethylbenzene-1-sulfonyl)piperazin-1-yl]pyrimidine
Compound characteristics
| Compound ID: | D430-1060 |
| Compound Name: | 2-methyl-4-(pyrrolidin-1-yl)-6-[4-(2,4,5-trimethylbenzene-1-sulfonyl)piperazin-1-yl]pyrimidine |
| Molecular Weight: | 429.58 |
| Molecular Formula: | C22 H31 N5 O2 S |
| Smiles: | Cc1cc(C)c(cc1C)S(N1CCN(CC1)c1cc(nc(C)n1)N1CCCC1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9746 |
| logD: | 4.9116 |
| logSw: | -4.694 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 56.139 |
| InChI Key: | YKKDOQMQRRJZMZ-UHFFFAOYSA-N |