1-{4-[3-({[4-tert-butyl-6-(diethylamino)pyrimidin-2-yl]sulfanyl}methyl)benzoyl]piperazin-1-yl}ethan-1-one
Chemical Structure Depiction of
1-{4-[3-({[4-tert-butyl-6-(diethylamino)pyrimidin-2-yl]sulfanyl}methyl)benzoyl]piperazin-1-yl}ethan-1-one
1-{4-[3-({[4-tert-butyl-6-(diethylamino)pyrimidin-2-yl]sulfanyl}methyl)benzoyl]piperazin-1-yl}ethan-1-one
Compound characteristics
| Compound ID: | V011-9561 |
| Compound Name: | 1-{4-[3-({[4-tert-butyl-6-(diethylamino)pyrimidin-2-yl]sulfanyl}methyl)benzoyl]piperazin-1-yl}ethan-1-one |
| Molecular Weight: | 483.68 |
| Molecular Formula: | C26 H37 N5 O2 S |
| Salt: | not_available |
| Smiles: | CCN(CC)c1cc(C(C)(C)C)nc(n1)SCc1cccc(c1)C(N1CCN(CC1)C(C)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4473 |
| logD: | 4.4467 |
| logSw: | -4.3409 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 53.304 |
| InChI Key: | VWIYRPMGHVIXAF-UHFFFAOYSA-N |