(4-ethylphenyl){4-[2-(2-methylpropyl)-6,7,8,9-tetrahydro-5H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-yl]piperazin-1-yl}methanone
Chemical Structure Depiction of
(4-ethylphenyl){4-[2-(2-methylpropyl)-6,7,8,9-tetrahydro-5H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-yl]piperazin-1-yl}methanone
(4-ethylphenyl){4-[2-(2-methylpropyl)-6,7,8,9-tetrahydro-5H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-yl]piperazin-1-yl}methanone
Compound characteristics
Compound ID: | V001-2011 |
Compound Name: | (4-ethylphenyl){4-[2-(2-methylpropyl)-6,7,8,9-tetrahydro-5H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-yl]piperazin-1-yl}methanone |
Molecular Weight: | 476.68 |
Molecular Formula: | C28 H36 N4 O S |
Salt: | not_available |
Smiles: | CCc1ccc(cc1)C(N1CCN(CC1)c1c2c3CCCCCc3sc2nc(CC(C)C)n1)=O |
Stereo: | ACHIRAL |
logP: | 7.2978 |
logD: | 6.7146 |
logSw: | -5.7447 |
Hydrogen bond acceptors count: | 4 |
Polar surface area: | 40.998 |
InChI Key: | CZMIOZHZKMCVOA-UHFFFAOYSA-N |