1-{4-[4-({[4-(methoxymethyl)-6-(morpholin-4-yl)pyrimidin-2-yl]sulfanyl}methyl)benzoyl]piperazin-1-yl}ethan-1-one
Chemical Structure Depiction of
1-{4-[4-({[4-(methoxymethyl)-6-(morpholin-4-yl)pyrimidin-2-yl]sulfanyl}methyl)benzoyl]piperazin-1-yl}ethan-1-one
1-{4-[4-({[4-(methoxymethyl)-6-(morpholin-4-yl)pyrimidin-2-yl]sulfanyl}methyl)benzoyl]piperazin-1-yl}ethan-1-one
Compound characteristics
| Compound ID: | V012-9199 |
| Compound Name: | 1-{4-[4-({[4-(methoxymethyl)-6-(morpholin-4-yl)pyrimidin-2-yl]sulfanyl}methyl)benzoyl]piperazin-1-yl}ethan-1-one |
| Molecular Weight: | 485.6 |
| Molecular Formula: | C24 H31 N5 O4 S |
| Smiles: | CC(N1CCN(CC1)C(c1ccc(CSc2nc(COC)cc(n2)N2CCOCC2)cc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.7113 |
| logD: | 1.7111 |
| logSw: | -2.193 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 70.848 |
| InChI Key: | QXTYXFLDTQNEFA-UHFFFAOYSA-N |