1-{4-[3-({[4-ethyl-6-(morpholin-4-yl)pyrimidin-2-yl]sulfanyl}methyl)benzoyl]piperazin-1-yl}ethan-1-one
Chemical Structure Depiction of
1-{4-[3-({[4-ethyl-6-(morpholin-4-yl)pyrimidin-2-yl]sulfanyl}methyl)benzoyl]piperazin-1-yl}ethan-1-one
1-{4-[3-({[4-ethyl-6-(morpholin-4-yl)pyrimidin-2-yl]sulfanyl}methyl)benzoyl]piperazin-1-yl}ethan-1-one
Compound characteristics
| Compound ID: | V011-2739 |
| Compound Name: | 1-{4-[3-({[4-ethyl-6-(morpholin-4-yl)pyrimidin-2-yl]sulfanyl}methyl)benzoyl]piperazin-1-yl}ethan-1-one |
| Molecular Weight: | 469.61 |
| Molecular Formula: | C24 H31 N5 O3 S |
| Salt: | not_available |
| Smiles: | CCc1cc(nc(n1)SCc1cccc(c1)C(N1CCN(CC1)C(C)=O)=O)N1CCOCC1 |
| Stereo: | ACHIRAL |
| logP: | 2.739 |
| logD: | 2.7386 |
| logSw: | -2.809 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 62.424 |
| InChI Key: | UNIJEYJAKDBJAY-UHFFFAOYSA-N |